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13330-29-5 | Benzenamine, 4-butyl-N,N-dimethyl-
CAS No: 13330-29-5 Catalog No: AG0014L0 MDL No:MFCD01567118
Product Description
Catalog Number:
AG0014L0
Chemical Name:
Benzenamine, 4-butyl-N,N-dimethyl-
CAS Number:
13330-29-5
Molecular Formula:
C12H19N
Molecular Weight:
177.2860
MDL Number:
MFCD01567118
IUPAC Name:
4-butyl-N,N-dimethylaniline
InChI:
InChI=1S/C12H19N/c1-4-5-6-11-7-9-12(10-8-11)13(2)3/h7-10H,4-6H2,1-3H3
InChI Key:
PJCNYQIIQZWBGS-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)N(C)C
NSC Number:
229364
Properties
Complexity:
123
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:
4
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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