Results for:
PubChem ID: 7768

Azepan-2-one

Mass-Spectra

Compound Details

Synonymous names
azepan-2-one
CAPROLACTAM
epsilon-Caprolactam
105-60-2
6-Caprolactam
2-Oxohexamethylenimine
Aminocaproic lactam
2H-Azepin-2-one, hexahydro-
6-Hexanelactam
2-Azacycloheptanone
Hexahydro-2H-azepin-2-one
2-Oxohexamethyleneimine
Hexanolactam
2-Perhydroazepinone
Hexahydro-2-azepinone
1,6-Hexolactam
Hexanone isoxime
Caprolattame
2-Ketohexamethylenimine
Cyclohexanone iso-oxime
E-Caprolactam
1-Aza-2-cycloheptanone
Epsylon kaprolaktam
Hexanonisoxim
Kaprolaktam
6-Aminocaproic acid lactam
Extrom 6N
hexannic acid
e-Kaprolaktam
Hexamethylenimine, 2-oxo-
Caprolactam monomer
1,6-Hexalactam
2-Ketohexamethyleneimine
Kapromine
Stilon
E-caprolactum
6-Aminohexanoic acid cyclic lactam
Perhydroazepin-2-one
2H-Azepin-7-one, hexahydro-
gamma-caprolactam
omega-caprolactum
Capron PK4
.epsilon.-Caprolactam
Hexanoic acid, 6-amino-, lactam
NCI-C50646
.omega.-Caprolactam
2H-azepin-7-one,hexahydro
Hexanoic acid, 6-amino-, cyclic lactam
Aza-2-cycloheptanone
CCRIS 119
HSDB 187
EINECS 203-313-2
Lactam, aminocaproic
NSC 117393
hexanoic acid-6-amino-,lactam
BRN 0106934
DTXSID4020240
CHEBI:28579
AI3-14515
UNII-6879X594Z8
A1030
MFCD00006936
cis-Hexahydro-2-azepinone
NSC-117393
hexahydro 2H Azepin 2 one
hexanoic acid-6-amino-lactam
DTXCID00240
6879X594Z8
FEMA NO. 4235
2-Azepinone, hexahydro-, (Z)-
EC 203-313-2
5-21-06-00444 (Beilstein Handbook Reference)
Cyclohexanoneisooxime
Hexanoic acid, lactam
WLN: T7MVTJ
CAPROLACTAM (IARC)
CAPROLACTAM [IARC]
Hexanoic acid, cyclic lactam
CAPROLACTAM (USP-RS)
CAPROLACTAM [USP-RS]
HEXANOIC ACID,6-AMINO,LACTAM E-CAPROLACTAM
Caprolattame [French]
e-Kaprolaktam [Czech]
Hexanonisoxim [German]
Epsylon kaprolaktam [Polish]
CAS-105-60-2
epsilon-?Caprolactam
hexahydroazepin-2-one
ZINC ACEXAMATE IMPURITY D (EP IMPURITY)
ZINC ACEXAMATE IMPURITY D [EP IMPURITY]
Caprolactam dust and vapor
caprolactim
Alkamid
Chemlon
Danamid
Kaprolit
Kaprolon
Metamid
Orgamide
Steelon
Akulon
Capron
Grilon
Itamid
Kapron
Stylon
Vidlon
Widlon
Orgamid rmnocd
Durethan bk
Ultramid bmk
6-hexanolactam
Tarlon xb
Caprolon B
Caprolon V
Kaprolit B
Kaprolon B
Renyl mv
Tarnamid T
hexano-6-lactam
Itamide S
Capron B
Ertalon 6sa
Kapron A
Kapron B
Caprolactam,(S)
Relon P
epsilon caprolactam
Durethan bk 30S
Tarlon X-A
Tarnamid T 2
Ultramid B 3
Ultramid B 4
Ultramid B 5
2-Azepanone #
Durethan bkv 30H
Durethan bkv 55H
Itamide 25
Itamide 35
Miramid H 2
Miramid wm 55
Torayca N 6
epsilon -caprolactam
Tarnamid T 27
azacycloheptan-2-one
Capran 77C
Capran 80
Plaskon 8201hs
Plaskon xp 607
Itamide 250
Itamide 250G
Itamide 350
Plaskon 201
Spencer 401
Spencer 601
azacycloheptane-2-one
Sipas 60
Itamid 250
Maranyl F 114
Maranyl F 124
Maranyl F 500
Nylon A1035sf
Plaskon 8202C
Capron gr 8256
Capron gr 8258
Plaskin 8200
Plaskon 8201
Plaskon 8205
Plaskon 8207
Plaskon 8252
6-CAPROLACTAN
Capron 8250
Capron 8252
Capron 8253
Capron 8256
Capron 8257
Nylon cm 1031
Zytel 211
?2-Oxohexamethylenimine
Amilan CM 1001C
Amilan CM 1001G
Amilan CM 1001
Amilan CM 1011
CAPROLACTAM [MI]
Dull 704
Nylon X 1051
CAPROLACTAM [HSDB]
ATM 2(NYLON)
bmse000372
epsilon-Caprolactam, 99%
6-Aminohexanoic acid lactam
Hexahydro-2H-azepine-2-one
SCHEMBL19610
9012-16-2
CHEMBL276218
PK 4
HEXAMETHYLENIMINE,2-OXO-
NIOSH/CM3900000
1,6-HEXALACTAM [FHFI]
UBE 1022B
NSC4977
2H-AZEPIN-2-ONE,HEXAHYDRO
NSC-4977
NSC25536
STR02412
Tox21_202202
Tox21_300163
c0432
MFCD19226350
NSC-25536
NSC117393
STK378587
AKOS000119969
CM 1001
CM 1011
CM 1031
CM 1041
MCULE-4544579564
epsilon-Caprolactam, analytical standard
NCGC00247913-01
NCGC00247913-02
NCGC00253933-01
NCGC00259751-01
AM802872
DB-003880
DB-032192
CM39000000
NS00008125
EN300-19667
A23500
C06593
D70254
Q409397
J-510225
F0001-0110
InChI=1/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8
Microorganism:

Yes

IUPAC nameazepan-2-one
SMILESC1CCC(=O)NCC1
InchiInChI=1S/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8)
FormulaC6H11NO
PubChem ID7768
Molweight113.16
LogP-0.1
Atoms8
Bonds0
H-bond Acceptor1
H-bond Donor1
Chemical Classificationamides lactames nitrogen compounds
CHEBI-ID28579
Supernatural-IDSN0160970

mVOC Specific Details

Boiling Point
DegreeReference
270 °C peer reviewed
Volatilization
The Henry's Law constant for caprolactam is estimated as 5.4X10-11 atm-cu m/mole(SRC), calculated from its vapor pressure, 1.9X10-3 mm Hg at 25 deg C(1), and water solubility, 5.25X10+6 mg/l(2). This Henry's Law constant indicates that caprolactam is expected to be essentially nonvolatile from water surfaces(3). Caprolactam's estimated Henry's Law constant indicates that volatilization from moist soil surfaces will not occur(SRC). Caprolactam is not expected to volatilize from dry soil surfaces(SRC) based upon its vapor pressure(1).
Literature: (1) Jones AM; J Chem Eng Data 5: 196-200 (1960) (2) Loewengart G; pp. 36-52 in Proc Symp Ind Approach Chem Risk Assess: Caprolactam Relat Compd Case Study, Arlington, VA: Marriott-Crystal Gateway (1984) (2) Duke SO; Rev. Weed Sci 2:15-44 (1986) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc for caprolactam is estimated to be 57(SRC). According to a classification scheme(2), this estimated Koc value suggests that caprolactam is expected to have high mobility in soil.
Literature: (1) Meylan WM et al; Environ Sci Technol 26: 1560-67 (1992) (2) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
1.9X10-3 mm Hg at 25 deg CJones AH; J Chem Eng Data 5: 196-200 (1960)
MS-Links
1D-NMR-Links
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStenotrophomonas MaltophiliaclinicPreti et al. 2009
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStenotrophomonas MaltophiliaBlood agar/chocolate blood agaHS-SPME/GC-MS no