Basic information
- CAS
947-92-2- Standard SMILES
O=NN(C1CCCCC1)C1CCCCC1- InChIKey
CYMNKXLBEMEABS-UHFFFAOYSA-N- Molecular formula
- C12H22N2O
- Average molar mass
- 210.32 g/mol
- Monoisotopic mass
- 210.17321333
Names & identifiers
- Preferred name
- N-Nitrosodicyclohexylamine
- IUPAC
- N,N-dicyclohexylnitrous amide
- English name
- N-NITROSO DICYCLOHEXYLAMINE
- Molecular formula
- C12H22N2O
- Molecular weight
- 210.32
Names & synonyms
N-Nitrosodicyclohexylamine947-92-2DicyclohexylnitrosamineDicyclohexylnitrosaminDTXSID4073128RefChem:163992DTXCID4048937N,N-dicyclohexylnitrous amideCyclohexanamine, N-cyclohexyl-N-nitroso-N-cyclohexyl-N-nitrosocyclohexanamineDICYCLOHEXYLAMINE, N-NITROSO-NSC-337
Show more names
RMA-712Glipizide Impurity 29n-nitroso-dicyclohexylaminN-Nitroso-dicyclonexylamineN-NITROSO DICYCLOHEXYLAMINE1,1-Dicyclohexyl-2-oxohydrazine
NSC 337CCRIS 2775Dicyclohexylnitrosamin [German]nitrosodicyclohexylamineBRN 1842001AI3-03644NDCHA5HQ3J54UCD
Database identifiers
- CAS
947-92-2- PubChem CID
- 13697
- DTXSID
DTXSID4073128- ChEMBL
CHEMBL164645- UNII
- 5HQ3J54UCD
- Nikkaji
- J42.225H
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 178
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Nitrosamines
Physical DescriptionSolid; [Sigma-Aldrich MSDS]
Physicochemical properties
- Melting point
- 95 · 95-97°C
- Boiling point
- 349.85 °C · 349.85°C (rough estimate)
- Density
- 0.9848 · 0.9848 (rough estimate)
- refractive index
- 1.476 · 1.4760 (estimate)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly, Heated)
- form
- Solid
- pka
- -2.65 · -2.65±0.20(Predicted)
- color
- White to Yellow
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- N-Nitrosodicyclohexylamine (947-92-2)
- Toxicity
- 50 orl-rat: · LD50 orl-rat: 5 g/kg ZEKBAI 69,103,67
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS] See NITROSAMINES.
Safety data
- Toxicity
- LD50 orl-rat: 5 g/kg ZEKBAI 69,103,67
Chemistry & industry
Applications
UsesA novel anti-androgenic compound. A carcinogenic agent.
Suppliers35 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
上海艾梯西生物科技有限公司18721763493 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
吉林中科研伸科技有限公司0431-80534353 19917294565 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
南京博济达医药科技有限公司18762407961 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
山东领海生物科技有限公司15092083467 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
上海泰坦科技股份有限公司13023226327 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Aladdin Scientific[email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
上海安谱实验科技股份有限公司18502138905 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
河南赢创生物科技有限公司16650708709 · [email protected]
河南科弘生物科技有限公司0371-55969461 18638736641 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
上海锐谱医药科技有限公司15895968936 · [email protected]
卡托研究化学公司+86-020-81960175-877 4000-868-328;4000-868-328 · [email protected]
Related reactions
1 records
Compound notes
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