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750597-51-4 | Benzenamine,4-methoxy-2-(2-methyl-1-propen-1-yl)-
CAS No: 750597-51-4 Catalog No: AG0056SY MDL No:
Product Description
Catalog Number:
AG0056SY
Chemical Name:
Benzenamine,4-methoxy-2-(2-methyl-1-propen-1-yl)-
CAS Number:
750597-51-4
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
IUPAC Name:
4-methoxy-2-(2-methylprop-1-enyl)aniline
InChI:
InChI=1S/C11H15NO/c1-8(2)6-9-7-10(13-3)4-5-11(9)12/h4-7H,12H2,1-3H3
InChI Key:
LMSWJQIUSYDGBF-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C=C(C)C)N
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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