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56038-89-2 | N-(1-Ethylpropyl)-3,4-dimethylaniline
CAS No: 56038-89-2 Catalog No: AG0035A5 MDL No:MFCD05662422
Product Description
Catalog Number:
AG0035A5
Chemical Name:
N-(1-Ethylpropyl)-3,4-dimethylaniline
CAS Number:
56038-89-2
Molecular Formula:
C13H21N
Molecular Weight:
191.3125
MDL Number:
MFCD05662422
IUPAC Name:
3,4-dimethyl-N-pentan-3-ylaniline
InChI:
InChI=1S/C13H21N/c1-5-12(6-2)14-13-8-7-10(3)11(4)9-13/h7-9,12,14H,5-6H2,1-4H3
InChI Key:
ZOTRFGNOTDLOAU-UHFFFAOYSA-N
SMILES:
CCC(Nc1ccc(c(c1)C)C)CC
EC Number:
611-347-8
UNII:
L2PBQ2GDBJ
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.167g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.318g/mol
Monoisotopic Mass:
191.167g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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