Basic information
- CAS
10108-56-2- Standard SMILES
CCCCNC1CCCCC1- InChIKey
VXXLEXCQCSPKFI-UHFFFAOYSA-N- Molecular formula
- C10H21N
- Average molar mass
- 155.28 g/mol
- Monoisotopic mass
- 155.16739967
Names & identifiers
- Preferred name
- N-Butyl cyclohexylamine
- IUPAC
- N-butylcyclohexanamine
- English name
- N-butylcyclohexylamine
- Molecular formula
- C10H21N
- Molecular weight
- 155.28
Names & synonyms
N-butylcyclohexanamineN-Butylcyclohexylamine10108-56-2ButylcyclohexylamineCyclohexanamine, N-butyl-Cyclohexylamine, N-butyl-(Butylamino)cyclohexaneHSDB 2770Cyclohexane, (butylamino)-EINECS 233-294-6N-BUTYL CYCLOHEXYLAMINE8HI5X9ZR2A
Show more names
Cyclohexylbutylamine
N-Butyl-N-(cyclohexyl)amineBRN 2346039AI3-11527CYCLOHEXYL-N-BUTYLAMINEDTXSID309059384-12-00-00020 (Beilstein Handbook Reference)N-BUTYL CYCLOHEXYLAMINE [HSDB]NButylcyclohexylamine
Database identifiers
- CAS
10108-56-2- PubChem CID
- 24946
- DTXSID
DTXSID30905938- UNII
- 8HI5X9ZR2A
- EC Number
- 233-294-6
- Nikkaji
- J23.470B
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 84.9
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Amines, Aliphatic
Density0.8
SolubilitySLIGHTLY SOL IN WATER; VERY SOL IN ALCOHOL, ETHER
Flash Point200 °F (93 °C) OC
Boiling Point207 °C
Physicochemical properties
- Melting point
- 208.3 °C · 208.3°C
- Boiling point
- 209.13 °C · 209.13°C (estimate)
- Density
- 0.8429 · 0.8429 (estimate)
- refractive index
- 1.4552 · 1.4552 (estimate)
- pka
- 11.23 · 11.23±0.20(Predicted)
- FDA UNII
- 8 HI5X9ZR2A · 8HI5X9ZR2A
- Hazardous Substances Data
- 10108 · 10108-56-2(Hazardous Substances Data)
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
Fire PotentialLOW, WHEN EXPOSED TO HEAT OR FLAME
Hazards SummaryExternal application to rabbit eyes scored 9 on a scale of 1-10 (10 being most severe) for degree of injury after 24 hours; Emergency treatment: Irritants; [HSDB]
NFPA Hazard Classification
2 - Materials that, under emergency conditions, can cause temporary incapacitation or residual injury.
1 - Materials that must be preheated before ignition can occur. Materials require considerable preheating, under all ambient temperature conditions, before ignition and combustion can occur.
0 - Materials that in themselves are normally stable, even under fire conditions.
Safety & protection
Fire Fighting Procedures"ALCOHOL" FOAM
Toxicology
Non-Human Toxicity Excerpts
N-BUTYLCYCLOHEXYLAMINE RATED 9 ON RABBIT EYES. /TESTED EXTERNALLY ON EYES OF RABBITS, RATED NUMERICALLY ON SCALE OF 1 TO 10 ACCORDING TO DEGREE OF INJURY OBSERVED AFTER 24 HR, PAYING PARTICULAR ATTENTION TO CONDITION OF CORNEA. MOST SEVERE INJURIES HAVE BEEN RATED 10/.
Safety data
- Hazardous Substances Data
- 10108-56-2(Hazardous Substances Data)
Chemistry & industry
Suppliers3 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
1 records
Compound notes
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