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168405-44-5 | Benzenemethanamine, 4-methoxy-2,5-dimethyl-
CAS No: 168405-44-5 Catalog No: AG001Y10 MDL No:
Product Description
Catalog Number:
AG001Y10
Chemical Name:
Benzenemethanamine, 4-methoxy-2,5-dimethyl-
CAS Number:
168405-44-5
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
IUPAC Name:
(4-methoxy-2,5-dimethylphenyl)methanamine
InChI:
InChI=1S/C10H15NO/c1-7-5-10(12-3)8(2)4-9(7)6-11/h4-5H,6,11H2,1-3H3
InChI Key:
GWARODYNRGXROB-UHFFFAOYSA-N
SMILES:
COc1cc(C)c(cc1C)CN
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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