Benzenemethanamine, 2-bromo-N-butyl-
Basic information
- CAS
60509-38-8- Standard SMILES
CCCCNCc1ccccc1Br- InChIKey
KZVDERULQMGZSD-UHFFFAOYSA-N- Molecular formula
- C11H16BrN
- Average molar mass
- 242.16 g/mol
- Monoisotopic mass
- 241.04661
Names & identifiers
- Preferred name
- Benzenemethanamine, 2-bromo-N-butyl-
- IUPAC
- N-[(2-bromophenyl)methyl]butan-1-amine
- English name
- N-(2-Bromophenylmethyl)butylamine
- Molecular formula
- C11H16BrN
- Molecular weight
- 242.16
Names & synonyms
60509-38-8Benzenemethanamine, 2-bromo-N-butyl-DTXSID40209252RefChem:324725DTXCID60131743[(2-BROMOPHENYL)METHYL](BUTYL)AMINEN-(2-Bromobenzyl)butan-1-amineN-[(2-bromophenyl)methyl]butan-1-amineN-(2-BROMOPHENYLMETHYL)BUTYLAMINEMFCD099989392-BROMO-N-BUTYL-BENZENEMETHANAMINEN-(2-bromobenzyl)butanamine
Show more names
UKRORGSYN-BB BBV-125665
CHEMBL1178159AKOS000234446DB-320204C78340EN300-168507
Database identifiers
- CAS
60509-38-8- PubChem CID
- 485402
- DTXSID
DTXSID40209252- ChEMBL
CHEMBL1178159- Nikkaji
- J1.984.873F
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 127
Physicochemical properties
- storage temp.
- Store at Room Tem.
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-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.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Suppliers
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Related reactions
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Compound notes
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