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81760-10-3 | 1-Butanamine, 3-methyl-N-(2-methylpropyl)-
CAS No: 81760-10-3 Catalog No: AG005I2L MDL No:
Product Description
Catalog Number:
AG005I2L
Chemical Name:
1-Butanamine, 3-methyl-N-(2-methylpropyl)-
CAS Number:
81760-10-3
Molecular Formula:
C9H21N
Molecular Weight:
143.2697
IUPAC Name:
3-methyl-N-(2-methylpropyl)butan-1-amine
InChI:
InChI=1S/C9H21N/c1-8(2)5-6-10-7-9(3)4/h8-10H,5-7H2,1-4H3
InChI Key:
GWMSJUSASQVTDR-UHFFFAOYSA-N
SMILES:
CC(CNCCC(C)C)C
Properties
Complexity:
67.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.167g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
143.274g/mol
Monoisotopic Mass:
143.167g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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