Results for:
chemical Classification: anthracenes

Anthracen-2-amine

Mass-Spectra

Compound Details

Synonymous names
beta-Aminoanthracene
YCSBALJAGZKWFF-UHFFFAOYSA-N
YCSBALJAGZKWFF-UHFFFAOYSA-
2-Aminoanthracene
2-Anthracenamide
2-ANTHRACENAMINE
2-Anthracylamine
2-Anthrylamine
2-Anthramine
.beta.-Aminoanthracene
anthracen-2-amine
AC1L1YH6
CCRIS 22
AC1Q526J
CHEMBL83154
Anthracene, 2-amino
ACMC-209mrd
6173AF
CTK2F4266
SCHEMBL103680
BIDD:ER0574
BIDD:GT0166
2-Aminoanthracene, 96%
C14417
HSDB 4041
HMS3039P14
PL002135
DTXSID2024458
SBB003612
LS-1467
NSC400535
AK325003
DSSTox_CID_4458
ZINC1593346
CHEBI:34260
A833154
CJ-25520
AN-46512
KB-20260
ANW-33767
8240818JGU
DSSTox_GSID_24458
CC-09107
C-08571
2-Anthramine (8CI)
DSSTox_RID_77406
ZINC01593346
MFCD00003582
NSC-400535
NSC 400535
ST45026846
TR-021126
UNII-8240818JGU
AI3-52501
RTR-021126
DB-053837
AKOS004904683
I05-0048
SMR001307303
MLS002302986
BRN 2209414
FT-0611224
WLN: L C666J EZ
Tox21_201567
Tox21_303299
613-13-8
NCGC00091622-02
NCGC00259116-01
NCGC00257001-01
NCGC00091622-03
NCGC00091622-01
MCULE-3149525306
EINECS 210-330-9
CAS-613-13-8
2-Aminoanthracene, technical, >=90% (HPLC)
MolPort-001-792-037
InChI=1/C14H11N/c15-14-6-5-12-7-10-3-1-2-4-11(10)8-13(12)9-14/h1-9H,15H2
Microorganism:

Yes

IUPAC nameanthracen-2-amine
SMILESC1=CC=C2C=C3C=C(C=CC3=CC2=C1)N
InchiInChI=1S/C14H11N/c15-14-6-5-12-7-10-3-1-2-4-11(10)8-13(12)9-14/h1-9H,15H2
FormulaC14H11N
PubChem ID11937
Molweight193.249
LogP3.12
Atoms26
Bonds28
H-bond Acceptor1
H-bond Donor1
Chemical Classificationanthracenes amines nitrogen containing compound benzenoids

mVOC Specific Details

Volatilization
The Henry's Law constant for 2-anthracenamine has been estimated to be 3.0X10-7 atm-cu m/mol at 25 deg C by combining a measured Henry's Law Constant for anthracene of 7.2X10-4 atm-cu m/mole at 25 deg C(1) with an estimation method based on structural bond contributions to intrinsic hydrophilic character(2,SRC). Given this value of Henry's Law constant and the relatively high Koc (15904 to 94276(4)) of 2-anthracenamine, it appears as though volatilization would not be a significant removal process from soil or water(3,SRC). This is apparent from the result of an EXAMS run for a model pond in which the effects of adsorption were considered. In this case, the volatilization half-life was determined to be 98 years(5,SRC).
Literature: (1) Mackay D et al; Environ Sci Tech 13: 333-7 (1982) (2) Hine J, Mookerjee PK J Org Chem 40: 292-8 (1975) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods NY: McGraw-Hill pp. 15-1 to 15-32 (1982) (4) Means JC et al; Environ Sci Tech 16: 93-8 (1982) (5) USEPA; EXAMS II computer simulation (1987)
Soil Adsorption
Koc ranging between 94276 and 15904 were measured for 2-anthracenamine in fourteen different soils and sediments(1). These Koc are indicative of extremely strong adsorption to soil and suspended solids and sediments in water(2,SRC).
Literature: (1) Means JC et al; Environ Sci Tech 16: 93-8 (1982) (2) Swann RL et al; Res Rev 85: 117-28 (1983)

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaShewanella Algae YM18nasea sediment in east China coastGong et al., 2015
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaShewanella Algae YM18NA mediumSPME-GC/MSNo