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13206-64-9 | Benzenamine, N-butyl-N-ethyl-
CAS No: 13206-64-9 Catalog No: AG00104Z MDL No:
Product Description
Catalog Number:
AG00104Z
Chemical Name:
Benzenamine, N-butyl-N-ethyl-
CAS Number:
13206-64-9
Molecular Formula:
C12H19N
Molecular Weight:
177.2860
IUPAC Name:
N-butyl-N-ethylaniline
InChI:
InChI=1S/C12H19N/c1-3-5-11-13(4-2)12-9-7-6-8-10-12/h6-10H,3-5,11H2,1-2H3
InChI Key:
DDKZXSNRYKHKQK-UHFFFAOYSA-N
SMILES:
CCCCN(c1ccccc1)CC
Properties
Complexity:
116
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:
5
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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