Basic information
- CAS
6335-97-3- Standard SMILES
CCCCCCCCN(CCCCCCCC)N=O- InChIKey
FLYCLWANFMDRKT-UHFFFAOYSA-N- Molecular formula
- C16H34N2O
- Average molar mass
- 270.45 g/mol
- Monoisotopic mass
- 270.26711371
Names & identifiers
- Preferred name
- N-nitroso-N-octyl-1-octanamine
- IUPAC
- N,N-dioctylnitrous amide
- English name
- Dioctylnitrosoamine
- Molecular formula
- C16H34N2O
- Molecular weight
- 270.45
Names & synonyms
Dioctylnitrosoamine6335-97-3Nitrosodi-N-octylamineN-Nitroso-N-octyl-1-octanamineDTXSID60212743RefChem:854375DTXCID90135234DioctylnitrosamineNitrosodioctylamineN,N-dioctylnitrous amideN-DioctylnitrosamineDioctylamine, N-nitroso-
Show more names
RMA-701N-Nitroso DioctylamineN-Nitrosodi-n-octylamine in acetonitrile
N-Nitroso-di-n-octylamine1-Octanamine, N-nitroso-N-octyl-NSC 38886DIOCYTLAMINE, N-NITROSO-NSC-38886BRN 1785059Di-n-octyl nitrosamineN-Nitrosodi-n-octylamine
Database identifiers
- CAS
6335-97-3- PubChem CID
- 22803
- DTXSID
DTXSID60212743- ChEMBL
CHEMBL167420- UNII
- U35LJ5Z8WE
- EC Number
- 987-967-0
- Nikkaji
- J2.245D
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 14
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 170
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Nitrosamines
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P264, P270, P280, P301+P317, P318, P330, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazards SummarySee NITROSAMINES.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers6 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
南京博济达医药科技有限公司18762407961 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
河南科弘生物科技有限公司0371-55969461 18638736641 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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