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773132-83-5

773132-83-5 | 3-(4-Amino-3-pyridinyl)-2-propenoic acid

CAS No: 773132-83-5 Catalog No: AG005NPY MDL No:

Product Description

Catalog Number:
AG005NPY
Chemical Name:
3-(4-Amino-3-pyridinyl)-2-propenoic acid
CAS Number:
773132-83-5
Molecular Formula:
C8H8N2O2
Molecular Weight:
164.1613
IUPAC Name:
3-(4-aminopyridin-3-yl)prop-2-enoic acid
InChI:
InChI=1S/C8H8N2O2/c9-7-3-4-10-5-6(7)1-2-8(11)12/h1-5H,(H2,9,10)(H,11,12)
InChI Key:
DVXPOYXSNKWPOE-UHFFFAOYSA-N
SMILES:
Nc1ccncc1C=CC(=O)O

Properties

Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
164.164g/mol
Monoisotopic Mass:
164.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
0.1  

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