Results for:
PubChem ID: 931

Naphthalene

Mass-Spectra

Compound Details

Synonymous names
naphthalene
91-20-3
Naphthalin
Albocarbon
Tar camphor
White tar
Naphthene
Naphthaline
Camphor tar
Moth balls
Moth flakes
naphtalene
Dezodorator
Naftalen
Mighty 150
Naphthalinum
RCRA waste number U165
Mighty RD1
naftaleno
naftalina
naphtaline
naphthalen
napthalene
Naphtalinum
Mothballs
Caswell No. 587
NCI-C52904
Naphthalene, pure
NSC 37565
CCRIS 1838
HSDB 184
Naphtalene [ISO:French]
EINECS 202-049-5
NSC-37565
EPA Pesticide Chemical Code 055801
UNII-2166IN72UN
DTXSID8020913
CHEBI:16482
AI3-00278
2166IN72UN
Naphthalene-1,2,3,4-13C4
CHEMBL16293
DTXCID00913
EC 202-049-5
NSC37565
Naphthalene, 99%
MFCD00001742
NCGC00090793-02
287399-39-7
Naphtalene (ISO:French)
NAPHTHALENE (IARC)
NAPHTHALENE [IARC]
NAPHTHALENE (MART.)
NAPHTHALENE [MART.]
Naftalen [Polish]
NAPHTHALENE (USP-RS)
NAPHTHALENE [USP-RS]
68412-25-9
Naphthalene, analytical standard
Naphthalene [BSI:ISO]
C10H8
CAS-91-20-3
Naphthalene, molten
Naphthalene (molten)
UN1334
UN2304
RCRA waste no. U165
NAPHTHALENE (1,2,3,4,5,6,7,8-D8)
Naphthalene, crude or refined
2-naphthalen
1-Naphthalene
2-Naphthalene
Na-Cemmix
Naphthalene,(S)
Naphthalene, 98%
1,4-naphthalenediyl
NAPHTHALENE [MI]
NAPHTHALENE [ISO]
NAPHTHALENE [HSDB]
NAPHTHALENE, REFINED
NAPHTHALINUM [HPUS]
NAPHTHALENE [WHO-DD]
MLS001055498
WLN: L66J
BIDD:ER0665
DTXSID201315549
HMS3039N15
AMY22299
Tox21_111023
Tox21_202004
Tox21_300008
BDBM50159249
Naphthalene, for synthesis, 98.5%
STL282720
AKOS000119977
USEPA/OPP Pesticide Code 055801
MCULE-8231589350
Naphthalene 100 microg/mL in Methanol
UN 1334
UN 2304
Naphthalene 10 microg/mL in Cyclohexane
NCGC00090793-01
NCGC00090793-03
NCGC00090793-04
NCGC00090793-05
NCGC00254058-01
NCGC00259553-01
BS-22320
Naphthalene 10 microg/mL in Acetonitrile
SMR000677944
Naphthalene 100 microg/mL in Acetonitrile
Naphthalene, SAJ first grade, >=98.0%
DB-361346
N0004
N0885
NS00008377
EN300-21626
C00829
D97670
Naphthalene, suitable for scintillation, >=99%
L001166
Naphthalene, molten [UN2304] [Flammable solid]
Q179724
SR-01000854997
Melting point standard 79-81C, analytical standard
SR-01000854997-2
F0001-2217
Naphthalene, certified reference material, TraceCERT(R)
Z104506008
Naphthalene, crude or refined [UN1334] [Flammable solid]
Naphthalene, United States Pharmacopeia (USP) Reference Standard
InChI=1/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8
Naphthalene, Pharmaceutical Secondary Standard; Certified Reference Material
25135-16-4
31807-65-5
72931-45-4
Microorganism:

Yes

IUPAC namenaphthalene
SMILESC1=CC=C2C=CC=CC2=C1
InchiInChI=1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H
FormulaC10H8
PubChem ID931
Molweight128.17
LogP3.3
Atoms10
Bonds0
H-bond Acceptor0
H-bond Donor0
Chemical Classificationaromatic compounds benzenoids
CHEBI-ID16482
Supernatural-IDSN0369332

mVOC Specific Details

Boiling Point
DegreeReference
217.9 NA peer reviewed
Volatilization
The Henry's Law constant for naphthalene is 4.4X10-4 atm-cu m/mole(1). This Henry's Law constant indicates that naphthalene is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 6 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 5 days(SRC). In laboratory experiments conducted at room temperature, the volatilization half-life of naphthalene was shown to range from 0.17 hours (depth of water 7.2 cm) to 11.55 hours (depth of water 8.5 cm)(3). Naphthalene's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). The estimated volatilization half-life for naphthalene from soil is 1.1 days, and 14 days when incorporated at a depth of 1 cm and 10 cm, respectively(4).
Literature: (1) Shiu WY, Mackay D; J Chem Eng Data 42: 951-953 (1997) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Smith JH et al; Chemosphere 10: 281-289 (1981) (4) Jury WA et al; J Environ Qual 13: 573-579 (1984)
Soil Adsorption
The mean Koc value of naphthalene in 17 soils throughout the US was 871(1). The Koc of naphthalene in 5 different soils from Japan ranged from 440-830(2). In a long term field experiment in Uppsala, Sweden, soils were treated with 7 types of amendments and 1 untreated plot, Koc values were 112-680 for naphthalene(3). In a contaminated soil collected from a railway station in Spain, naphthalene had a log Koc of 3.97(4). The mean Koc value of naphthalene in sediment samples from 2 ponds and 1 river from north Georgia, US was 1,300(5). The log Koc value in sediment was 2.84(6). In 76 sediment samples from 7 sites in New York and 1 in North Carolina, naphthalene had log Koc values of 2.45-5.59(7). According to a classification scheme(8), these Koc values suggest that naphthalene is expected to have high to no mobility in soil(SRC).
Literature: (1) Karickoff SW; Chemosphere 10: 833-846 (1981) (2) Kishi H et al; Chemosphere 21: 975-89 (1990) (3) Novoszad M et al; Chemosphere 59: 639-47 (2005) (4) ter Laak TL et al; Environ Sci Technol 40:2184-90 (2006) (5) Karickoff SW et al; Wat Res 13: 241-248 (1979) (6) Beckles DM et al; Environ Toxicol Chem 26: 878-83 (2007) (7) Hawthorne SB et al; Environ Toxicol Chem 25: 2901-11 (2006) (8) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
0.085 mm Hg at 25 deg CAmbrose D et al; J Chem Soc Trans 71: 35-41 (1975)
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaEscherichia ColiNANADixon et al. 2022
EukaryotaTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
EukaryotaTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al. 2003
EukaryotaFusarium Graminearumn/aNABusko et al. 2014
ProkaryotaPseudomonas Syringaenaphyllosphere of field-grown potato plantsHunziker et al. 2015
EukaryotaMuscodor Vitigenusliana, Amazon, south PeruDaisy et al. 2002
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaEscherichia ColiLBTD/GC-MSno
EukaryotaTuber Aestivumn/an/ano
EukaryotaTuber Melanosporumn/an/ano
EukaryotaFusarium Graminearumyeast extract sucrose agarSPME/GC-MSno
ProkaryotaPseudomonas SyringaeLB mediumGC/MSyes
EukaryotaMuscodor Vitigenuspotato dextrose agarSPME, GCMSyes