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Home > Pyridines > 1007212-62-5
1007212-62-5 | 3-isocyanato-4-methylpyridine
CAS No: 1007212-62-5 Catalog No: AG01BCZN MDL No:MFCD13175913
Product Description
Catalog Number:
AG01BCZN
Chemical Name:
3-isocyanato-4-methylpyridine
CAS Number:
1007212-62-5
Molecular Formula:
C7H6N2O
Molecular Weight:
134.1353
MDL Number:
MFCD13175913
IUPAC Name:
3-isocyanato-4-methylpyridine
InChI:
InChI=1S/C7H6N2O/c1-6-2-3-8-4-7(6)9-5-10/h2-4H,1H3
InChI Key:
IFXDWHAYRDJEEB-UHFFFAOYSA-N
SMILES:
Cc1ccncc1N=C=O
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.048g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.138g/mol
Monoisotopic Mass:
134.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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