Basic information
- CAS
102-45-4- Standard SMILES
CNC(C)CC1CCCC1- InChIKey
HFXKQSZZZPGLKQ-UHFFFAOYSA-N- Molecular formula
- C9H19N
- Average molar mass
- 141.25 g/mol
- Monoisotopic mass
- 141.15174961
Overview
Cyclopentamine is a secondary amino compound.
Names & identifiers
- Preferred name
- Cyclopentamine
- IUPAC
- 1-cyclopentyl-N-methylpropan-2-amine
- English name
- Cyclopentamine
- Molecular formula
- C9H19N
- Molecular weight
- 141.25
Names & synonyms
Cyclopentamine102-45-4CyclonarolClopaneCiclopentaminaCyklosalCyclopentadrineCyclopentaminumN,alpha-DimethylcyclopentaneethylamineWB9Q6M8O60RefChem:580947R01AA02
Show more names
CxyklosalN,α-Dimethylcyclopentaneethanamine1-cyclopentyl-N-methyl-propan-2-amineCyclopentaneethanamine, N,α-dimethyl-
1-cyclopentyl-N-methylpropan-2-amineCyclopentadrinCyclopentaminCyklosanCyclopentamine (pharmacetical)Cyclopentamine [INN]2-Cyclopentyl-N,1-dimethylethylamine(1-cyclopentylpropan-2-yl)(methyl)amine
Database identifiers
- CAS
102-45-4- PubChem CID
- 7608
- DTXSID
DTXSID60861710- ChEMBL
CHEMBL329203- ChEBI
CHEBI:134766- UNII
- WB9Q6M8O60
- EC Number
- 982-538-4
- Nikkaji
- J5.008C
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 84.7
Experimental & physicochemical properties
Human DrugsPharmaceuticals
Melting Point113-115
Physicochemical properties
- Boiling point
- 171.05 °C · 171.05°C
- Density
- 0.7566 · 0.7566 (rough estimate)
- refractive index
- 1.492 · 1.4920 (estimate)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- 11.47 · pKa 11.47 (Uncertain)
- FDA UNII
- 9 Q6M8O60 · WB9Q6M8O60
- ATC code
- 1 AA02 · R01AA02
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
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P370+P378, P403+P233, P403+P235, 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
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Chemistry & industry
Pharmacology
ATC Code
R - Respiratory system
QR - Respiratory system
Uses & manufacturing
Use ClassificationPharmaceuticals
Upstream & downstream products
Upstream raw materials
Suppliers13 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
重庆张邦医药科技有限责任公司028-84252981 18583719936 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…