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Home > Pyridines > 282715-65-5
282715-65-5 | N-(pyridin-4-ylmethyl)thiourea
CAS No: 282715-65-5 Catalog No: AG0168ZR MDL No:MFCD00831476
Product Description
Catalog Number:
AG0168ZR
Chemical Name:
N-(pyridin-4-ylmethyl)thiourea
CAS Number:
282715-65-5
Molecular Formula:
C7H9N3S
Molecular Weight:
167.2315
MDL Number:
MFCD00831476
IUPAC Name:
pyridin-4-ylmethylthiourea
InChI:
InChI=1S/C7H9N3S/c8-7(11)10-5-6-1-3-9-4-2-6/h1-4H,5H2,(H3,8,10,11)
InChI Key:
UEVXNMMNVVJTRI-UHFFFAOYSA-N
SMILES:
NC(=S)NCc1ccncc1
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.052g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.23g/mol
Monoisotopic Mass:
167.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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