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89729-88-4 | Benzenamine, 4-(2-methoxy-1-methylethyl)-3-methyl-
CAS No: 89729-88-4 Catalog No: AG0041ZG MDL No:
Product Description
Catalog Number:
AG0041ZG
Chemical Name:
Benzenamine, 4-(2-methoxy-1-methylethyl)-3-methyl-
CAS Number:
89729-88-4
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
IUPAC Name:
4-(1-methoxypropan-2-yl)-3-methylaniline
InChI:
InChI=1S/C11H17NO/c1-8-6-10(12)4-5-11(8)9(2)7-13-3/h4-6,9H,7,12H2,1-3H3
InChI Key:
SWKZGBFVDCVCFI-UHFFFAOYSA-N
SMILES:
COCC(c1ccc(cc1C)N)C
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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