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Home > Pyridines > 694495-63-1
694495-63-1 | Carbamic acid, (4-methyl-3-pyridinyl)-, methyl ester
CAS No: 694495-63-1 Catalog No: AG005Z5H MDL No:MFCD09030045
Product Description
Catalog Number:
AG005Z5H
Chemical Name:
Carbamic acid, (4-methyl-3-pyridinyl)-, methyl ester
CAS Number:
694495-63-1
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
MDL Number:
MFCD09030045
IUPAC Name:
methyl N-(4-methylpyridin-3-yl)carbamate
InChI:
InChI=1S/C8H10N2O2/c1-6-3-4-9-5-7(6)10-8(11)12-2/h3-5H,1-2H3,(H,10,11)
InChI Key:
FTEFYIXMXZZAGN-UHFFFAOYSA-N
SMILES:
Cc1ccncc1NC(=O)OC
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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