Home Other Building Blocks 3-methyl-1-(2-methylphenyl)butan-1-amine

3-methyl-1-(2-methylphenyl)butan-1-amine

CAS No.:
854185-27-6
Catalog Number:
AG01AHKI
Molecular Formula:
C12H19N
Molecular Weight:
177.2860
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Product Description
Catalog Number:
AG01AHKI
Chemical Name:
3-methyl-1-(2-methylphenyl)butan-1-amine
CAS Number:
854185-27-6
Molecular Formula:
C12H19N
Molecular Weight:
177.2860
MDL Number:
MFCD12154046
IUPAC Name:
3-methyl-1-(2-methylphenyl)butan-1-amine
InChI:
InChI=1S/C12H19N/c1-9(2)8-12(13)11-7-5-4-6-10(11)3/h4-7,9,12H,8,13H2,1-3H3
InChI Key:
JLSPINKVLBVMGK-UHFFFAOYSA-N
SMILES:
CC(CC(c1ccccc1C)N)C
Properties
Complexity:
142  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
177.291g/mol
Monoisotopic Mass:
177.152g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties