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832733-17-2 | Pyridine, dimethyl-, acetate
CAS No: 832733-17-2 Catalog No: AG004XVY MDL No:
Product Description
Catalog Number:
AG004XVY
Chemical Name:
Pyridine, dimethyl-, acetate
CAS Number:
832733-17-2
Molecular Formula:
C9H13NO2
Molecular Weight:
167.2050
IUPAC Name:
acetic acid;2,3-dimethylpyridine
InChI:
InChI=1S/C7H9N.C2H4O2/c1-6-4-3-5-8-7(6)2;1-2(3)4/h3-5H,1-2H3;1H3,(H,3,4)
InChI Key:
DTFOIYPZPIQJCV-UHFFFAOYSA-N
SMILES:
Cc1ncccc1C.CC(=O)O
Properties
Complexity:
102
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.208g/mol
Monoisotopic Mass:
167.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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