Basic information
- Standard SMILES
CC(C)c1ccc(N)cc1Br- InChIKey
ZDWAJOHLJMQPPU-UHFFFAOYSA-N- Molecular formula
- C9H12BrN
- Average molar mass
- 214.1 g/mol
Names & identifiers
- Preferred name
- 3-Bromo-4-isopropylaniline
- IUPAC
- 3-bromo-4-propan-2-ylaniline
Names & synonyms
3-Bromo-4-isopropylaniline112299-61-33-bromo-4-propan-2-ylanilineNSC1329663-Bromo-4-isopropylbenzenamineSCHEMBL1684340ZDWAJOHLJMQPPU-UHFFFAOYSA-NGS2685MFCD23708531NSC-132966DB-204323CS-0253870
Show more names
F96398
Database identifiers
- PubChem CID
- 280799
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 125
Related reactions
4 records
Linked notes
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