Basic information
- CAS
2211-64-5- Standard SMILES
ONC1CCCCC1- InChIKey
GUQRKZPMVLRXLT-UHFFFAOYSA-N- Molecular formula
- C6H13NO
- Average molar mass
- 115.17 g/mol
- Monoisotopic mass
- 115.09971404
Names & identifiers
- Preferred name
- Cyclohexylhydroxylamine
- IUPAC
- N-cyclohexylhydroxylamine
- English name
- N-CYCLOHEXYLHYDROXYLAMINE
- Molecular formula
- C6H13NO
- Molecular weight
- 115.17
Names & synonyms
2211-64-5N-HydroxycyclohexylamineCyclohexylhydroxylamine722GHL96BJDTXSID90176627RefChem:163537DTXCID4099118218-650-0N-CyclohexylhydroxylamineN-HydroxycyclohexanamineCyclohexanamine, N-hydroxy-MFCD00021287
Show more names
HydroxyaminocyclohexaneN-CYCLOHEXYHYDROXYLAMINEn-cyclohexyl-hydroxylaminCyclohexylhydroxylamine (CyHHA)
Hydroxylamine, N-cyclohexyl-N-cyclohexyl-hydroxylamineEINECS 218-650-0BRN 0605426UNII-722GHL96BJSCHEMBL243510SCHEMBL3185337SCHEMBL7458103
Database identifiers
- CAS
2211-64-5- PubChem CID
- 72935
- DTXSID
DTXSID90176627- UNII
- 722GHL96BJ
- EC Number
- 218-650-0
- Nikkaji
- J3.389H
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 59
Physicochemical properties
- Melting point
- 139 · 139-140 °C(lit.)
- Boiling point
- 215.49 °C · 215.49°C (rough estimate)
- Density
- 0.9837 · 0.9837 (rough estimate)
- refractive index
- 1.469 · 1.4690 (estimate)
- storage temp.
- -20 °C · -20°C
- pka
- 14.14 · 14.14±0.20(Predicted)
- form
- solid
- InChI
- 1S/C6H13NO/c8-7-6-4-2-1-3-5-6/h6-8H,1-5H2
- InChIKey
- GUQRKZPMVLRXLT-UHFFFAOYSA-N
- SMILES
- ONC1CCCCC1
- FDA UNII
- 722 GHL96BJ · 722GHL96BJ
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H318
- Precautionary statements
- 280 · P280-P301+P312+P330-P305+P351+P338+P310
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-41
- Safety Statements
- 26 · 26-39
- WGK Germany
- 2 · 2
- RTECS
- 3410400 · NC3410400
- HS Code
- 2928009090 · 2928009090
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Dam. 1
Safety & regulation
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 2
- rtecs
- NC3410400
- hs_code
- 2928009090
- risk_code
- 22-41
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xn
- safety_code
- 26-39
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H318
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1
- Precautionary statements
- P280-P301+P312+P330-P305+P351+P338+P310
Chemistry & industry
Applications
UsesReactant for:Aldehyde-catalyzed intermolecular hydroaminationCondensation reactionsPreparation of cyclin-dependent kinase inhibitors selective for multiple cyclin-dependent kinases for potential use as antitumor agentsPreparation of hydroxyurea derivatives as small molecule bradykinin B1 receptor antagonists
UsesN-Cyclohexylhydroxylamine is a reactant for:Aldehyde-catalyzed intermolecular hydroamination1• ;Condensation reactions2• ;Preparation of cyclin-dependent kinase inhibitors selective for multiple cyclin-dependent kinases for potential use as antitumor agents3• ;Preparation of hydroxyurea derivatives as small molecule bradykinin B1 receptor antagonists.
General DescriptionN-Cyclohexylhydroxylamine is formed as one of the by-products during the hydrogenation of nitrocyclohexane to the corresponding cyclohexanone oxime catalyzed by palladium/carbon nanotubes.
Upstream & downstream products
Downstream products
Suppliers34 total
上海药诚医药科技合伙企业（有限合伙）400-6181121 18616381138 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Syntechem Co.,Ltd[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
常州市宣明医药科技有限公司+86-519-85525359 +86-15995072465 · [email protected]
郑州今斯孚化学有限公司0371-56635027 13838252817 · [email protected]
北京泰亚杰科技有限公司021-33690831-8001 13552411790;18616022633 · [email protected]
上海特伯化学科技有限公司+86-21-60341587 · [email protected]
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
上海瀚思化工有限公司17717618050 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
上海康恩博医药科技有限公司400-1388-521 17510465506 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
常州新星联生物科技有限公司+86-0519-85551759 · [email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
广东胜克生化科技股份有限公司18925113981 18925113981 · [email protected]
河南威梯希化工科技有限公司0371-55135753 18003832934 · [email protected]
Related reactions
54 records
Compound notes
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