3-Methoxycyclohexan-1-amine
Basic information
- CAS
4342-44-3- Standard SMILES
COC1CCCC(N)C1- InChIKey
JQGZGROVQGEGIO-UHFFFAOYSA-N- Molecular formula
- C7H15NO
- Average molar mass
- 129.2 g/mol
- Monoisotopic mass
- 129.1153641
Names & identifiers
- Preferred name
- 3-Methoxycyclohexan-1-amine
- IUPAC
- 3-methoxycyclohexan-1-amine
- English name
- 3-Methoxy-cyclohexylamine
- Molecular formula
- C7H15NO
- Molecular weight
- 129.2
Names & synonyms
3-methoxycyclohexan-1-amine4342-44-3RefChem:503255834-622-63-Methoxy-cyclohexylamine3-Methoxycyclohexanamine(1R,3S)-3-Methoxy-cyclohexylamine(1S,3R)-3-Methoxy-cyclohexylaminecis-3-Methoxy-cyclohexylamineMFCD19649929(1R,3R)-3-methoxycyclohexanamine(1R,3S)-3-methoxycyclohexanamine
Show more names
Cyclohexanamine, 3-methoxy-
cis-3-methoxycyclohexanamineSCHEMBL3533597SCHEMBL28016604JQGZGROVQGEGIO-UHFFFAOYSA-NEAA34244AKOS013408680PB39519SB30461
Database identifiers
- CAS
4342-44-3- PubChem CID
- 409908
- EC Number
- 834-622-6
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 85
Physicochemical properties
- Boiling point
- 174.5 · 174.5±33.0 °C(Predicted)
- Density
- 0.94 · 0.94±0.1 g/cm3(Predicted)
- pka
- 10.16 · 10.16±0.70(Predicted)
- Symbol(GHS)
- 2 · GHS02,GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 226 · H226-H302-H335-H314
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
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%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07,GHS05
- Hazard statements
- H226-H302-H335-H314
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
2 records
Compound notes
Loading…