Home Other Building Blocks 3-BROMO-N-(2-METHYLPROPYL)ANILINE

3-BROMO-N-(2-METHYLPROPYL)ANILINE

CAS No.:
1021138-36-2
Catalog Number:
AG01DM4Z
Molecular Formula:
C10H14BrN
Molecular Weight:
228.1289
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Product Description
Catalog Number:
AG01DM4Z
Chemical Name:
3-BROMO-N-(2-METHYLPROPYL)ANILINE
CAS Number:
1021138-36-2
Molecular Formula:
C10H14BrN
Molecular Weight:
228.1289
MDL Number:
MFCD11144964
IUPAC Name:
3-bromo-N-(2-methylpropyl)aniline
InChI:
InChI=1S/C10H14BrN/c1-8(2)7-12-10-5-3-4-9(11)6-10/h3-6,8,12H,7H2,1-2H3
InChI Key:
YJHVIKWNRUJBKH-UHFFFAOYSA-N
SMILES:
CC(CNc1cccc(c1)Br)C
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.031g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.133g/mol
Monoisotopic Mass:
227.031g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties