200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 131424-34-5
131424-34-5 | 2-Propenoic acid, 3-thiocyanato-, (Z)- (9CI)
CAS No: 131424-34-5 Catalog No: AG000W4X MDL No:
Product Description
Catalog Number:
AG000W4X
Chemical Name:
2-Propenoic acid, 3-thiocyanato-, (Z)- (9CI)
CAS Number:
131424-34-5
Molecular Formula:
C4H3NO2S
Molecular Weight:
129.1371
IUPAC Name:
3-thiocyanatoprop-2-enoic acid
InChI:
InChI=1S/C4H3NO2S/c5-3-8-2-1-4(6)7/h1-2H,(H,6,7)
InChI Key:
OQYPGQSDSUQZBM-UHFFFAOYSA-N
SMILES:
OC(=O)/C=C\SC#N
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.988g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
129.133g/mol
Monoisotopic Mass:
128.988g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.