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Home > Pyridines > 1260667-49-9
1260667-49-9 | 4-ISOCYANATO-2-PYRROLIDIN-1-YLPYRIDINE
CAS No: 1260667-49-9 Catalog No: AG01BZ6N MDL No:MFCD18251075
Product Description
Catalog Number:
AG01BZ6N
Chemical Name:
4-ISOCYANATO-2-PYRROLIDIN-1-YLPYRIDINE
CAS Number:
1260667-49-9
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
MDL Number:
MFCD18251075
IUPAC Name:
4-isocyanato-2-pyrrolidin-1-ylpyridine
InChI:
InChI=1S/C10H11N3O/c14-8-12-9-3-4-11-10(7-9)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2
InChI Key:
LGUQMUGMMLNLGX-UHFFFAOYSA-N
SMILES:
O=C=Nc1ccnc(c1)N1CCCC1
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.218g/mol
Monoisotopic Mass:
189.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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