1-Phenylbutan-1-amine
Completing data — refresh the page later to see the latest
Basic information
- CAS
2941-19-7- Standard SMILES
CCCC(N)c1ccccc1- InChIKey
XHOXKVFLASIOJD-UHFFFAOYSA-N- Molecular formula
- C10H15N
- Average molar mass
- 149.23 g/mol
- Monoisotopic mass
- 149.12044948
Names & identifiers
- Preferred name
- 1-Phenylbutan-1-amine
- IUPAC
- 1-phenylbutan-1-amine
- English name
- 1-PHENYL-BUTYLAMINE
- Molecular formula
- C10H15N
- Molecular weight
- 149.23
Names & synonyms
1-phenylbutan-1-amine2941-19-7DTXSID00394072RefChem:233217DTXCID603449321-Phenyl-butylamine(1-PHENYLBUTYL)AMINEBenzenemethanamine, a-propyl-1-phenylbutylamineMFCD06379300CHEMBL22934(1R)-1-phenyl-1-butanamine
Show more names
CHEMBRDG-BB 40063201-Phenyl-1-butanamine1-Phenylbutane-1-amineα-Propylbenzenemethanaminea-Propyl-benzenemethanamineBenzenemethanamine, α-propyl-1-PHENYLBUTAN-1-AMINE HYDROCHLORIDE(1-phenylbutyl)amine(SALTDATA: HCl)
phenylbutanamine1-phenylbutyl amine1-(phenyl)-butylaminebenzene, (1-aminobutyl)-SCHEMBL44326SCHEMBL266309SCHEMBL1043478SCHEMBL3248164
Database identifiers
- CAS
2941-19-7- PubChem CID
- 3603785
- DTXSID
DTXSID00394072- ChEMBL
CHEMBL22934- EC Number
- 804-845-3
- Nikkaji
- J80.594G
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 95
Physicochemical properties
- Melting point
- 143 °C · 143°C (estimate)
- Boiling point
- 230.33 °C · 230.33°C (estimate)
- Density
- 0.9366 · 0.9366
- refractive index
- 1.5123 · 1.5123 (estimate)
- storage temp.
- Refrigerator, under inert atmosphere
- solubility
- Chloroform (Sparingly), Methanol (Slightly)
- form
- Oil
- color
- Colourless
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (66.7%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Applications
Uses1-Phenylbutan-1-amine is a useful compound for the preparation of primary amines and their hydrochloride salts.
Related reactions
12 records
Compound notes
Loading…