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129725-48-0 | Benzenemethanamine, 3-amino-α-methyl-
CAS No: 129725-48-0 Catalog No: AG000TM6 MDL No:MFCD06245432
Product Description
Catalog Number:
AG000TM6
Chemical Name:
Benzenemethanamine, 3-amino-α-methyl-
CAS Number:
129725-48-0
Molecular Formula:
C8H12N2
Molecular Weight:
136.1943
MDL Number:
MFCD06245432
IUPAC Name:
3-(1-aminoethyl)aniline
InChI:
InChI=1S/C8H12N2/c1-6(9)7-3-2-4-8(10)5-7/h2-6H,9-10H2,1H3
InChI Key:
MBWYRMCXWROJMP-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)C(N)C
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.1g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
136.198g/mol
Monoisotopic Mass:
136.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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