Basic information
- CAS
4998-76-9- Standard SMILES
[Cl-].[NH3+]C1CCCCC1- InChIKey
ZJUGSKJHHWASAF-UHFFFAOYSA-N- Molecular formula
- C6H14ClN
- Average molar mass
- 135.63 g/mol
- Monoisotopic mass
- 135.0814771
Overview
See also: Cyclohexylamine hydrochloride (preferred).
Names & identifiers
- Preferred name
- Cyclohexylazanium;chloride
- IUPAC
- cyclohexylazanium chloride
- English name
- Cyclohexylamine hydrochloride
- Molecular formula
- C6H14ClN
- Molecular weight
- 135.64
Names & synonyms
cyclohexylazanium;chlorideCAS-4998-76-9cyclohexylamine, chloridecyclohexanaminium chlorideEAA99876Tox21_201289Tox21_302760AKOS002321210NCGC00256393-01NCGC00258841-01NS00081655ST50322535
Show more names
CYCLOHEXYLAMINE HCLCYCLOHEXYLAMMONIUM CHLORIDEGlipizide Impurity 2(HCl)CyclohexylammoniumchloridCyclohexylamine HydrochoridecyclohexanaminehydrochlorideCYCLOHEXYLAMINE HYDROCHLORIDECyclohexanamine,hydrochlorideAMINOCYCLOHEXANE HYDROCHLORIDEHEXAHYDROANILINE HYDROCHLORIDE
Database identifiers
- CAS
4998-76-9- PubChem CID
- 21097
- DTXSID
DTXSID0020361
Properties
Computed structural properties
- Topological polar surface area
- 27.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 46.1
Physicochemical properties
- Melting point
- 207 °C · 207 °C
- Boiling point
- 306 °C · 306 °C
- Density
- 1.0013 · 1.0013 (rough estimate)
- refractive index
- 1.453 · 1.4530 (estimate)
- storage temp.
- Inert atmosphere,Room Temperature
- form
- Crystalline Powder or Crystals
- color
- White to beige
- Water Solubility
- 83 g/100 · 83 g/100 mL (17 ºC)
- Sensitive
- Hygroscopic
- BRN
- 3613002 · 3613002
- InChI
- InChI=1S/C6H13N.ClH/c7-6-4-2-1-3-5-6;/h6H,1-5,7H2;1H
- InChIKey
- ZJUGSKJHHWASAF-UHFFFAOYSA-N
- SMILES
- C1(N)CCCCC1.Cl
- CAS DataBase Reference
- 4998 · 4998-76-9(CAS DataBase Reference)
- FDA UNII
- 6 VYF8THC · TN6VYF8THC
- EPA Substance Registry System
- Cyclohexanamine, hydrochloride (4998-76-9)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
- rtecs
- GX1440000
- ridadr
- 2811
- hs_code
- 29213000
- risk_code
- 36/37/38-20/21/22-41-37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS06,GHS08
- hazard_code
- Xn,Xi
- safety_code
- 36/37/39-26-36
- Hazard statements
- H301-H335-H361-H302-H315-H319
- Precautionary statements
- P264-P270-P280-P301+P312+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P501-P201-P261-P301+P310a-P305+P351+P338-P405-P501a
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖北宥澄新材料科技有限公司17764017698 13163370568 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
科瑞迪化学400-821-5857 021-64326257 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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