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130000-78-1 | 2-Pyridinemethanamine, 4-methoxy-3,5-dimethyl-
CAS No: 130000-78-1 Catalog No: AG000TVN MDL No:MFCD10686625
Product Description
Catalog Number:
AG000TVN
Chemical Name:
2-Pyridinemethanamine, 4-methoxy-3,5-dimethyl-
CAS Number:
130000-78-1
Molecular Formula:
C9H14N2O
Molecular Weight:
166.2203
MDL Number:
MFCD10686625
IUPAC Name:
(4-methoxy-3,5-dimethylpyridin-2-yl)methanamine
InChI:
InChI=1S/C9H14N2O/c1-6-5-11-8(4-10)7(2)9(6)12-3/h5H,4,10H2,1-3H3
InChI Key:
CNPVFVHYBKQINB-UHFFFAOYSA-N
SMILES:
COc1c(C)cnc(c1C)CN
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.111g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.224g/mol
Monoisotopic Mass:
166.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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