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80861-23-0 | Benzenamine, 3-(2-methyl-3-phenylpropyl)-
CAS No: 80861-23-0 Catalog No: AG005IB9 MDL No:
Product Description
Catalog Number:
AG005IB9
Chemical Name:
Benzenamine, 3-(2-methyl-3-phenylpropyl)-
CAS Number:
80861-23-0
Molecular Formula:
C16H19N
Molecular Weight:
225.3288
IUPAC Name:
3-(2-methyl-3-phenylpropyl)aniline
InChI:
InChI=1S/C16H19N/c1-13(10-14-6-3-2-4-7-14)11-15-8-5-9-16(17)12-15/h2-9,12-13H,10-11,17H2,1H3
InChI Key:
RSEPDFJSGYWQAM-UHFFFAOYSA-N
SMILES:
CC(Cc1cccc(c1)N)Cc1ccccc1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.152g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.335g/mol
Monoisotopic Mass:
225.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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