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141032-65-7 | Benzenamine, N-methyl-N-(2-methylbutyl)-
CAS No: 141032-65-7 Catalog No: AG001FRY MDL No:
Product Description
Catalog Number:
AG001FRY
Chemical Name:
Benzenamine, N-methyl-N-(2-methylbutyl)-
CAS Number:
141032-65-7
Molecular Formula:
C12H19N
Molecular Weight:
177.2860
IUPAC Name:
N-methyl-N-(2-methylbutyl)aniline
InChI:
InChI=1S/C12H19N/c1-4-11(2)10-13(3)12-8-6-5-7-9-12/h5-9,11H,4,10H2,1-3H3
InChI Key:
JDYWUAJUGIUTCV-UHFFFAOYSA-N
SMILES:
CCC(CN(c1ccccc1)C)C
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.152g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.291g/mol
Monoisotopic Mass:
177.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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