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Home Other Building Blocks 2-methyl-3-(pyridin-4-yl)prop-2-enoic acid hydrochloride

2-methyl-3-(pyridin-4-yl)prop-2-enoic acid hydrochloride

CAS No.:
1909358-80-0
Catalog Number:
AG01B1WS
Molecular Formula:
C9H10ClNO2
Molecular Weight:
199.6342
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Product Description
Catalog Number:
AG01B1WS
Chemical Name:
2-methyl-3-(pyridin-4-yl)prop-2-enoic acid hydrochloride
CAS Number:
1909358-80-0
Molecular Formula:
C9H10ClNO2
Molecular Weight:
199.6342
MDL Number:
MFCD29907211
IUPAC Name:
2-methyl-3-pyridin-4-ylprop-2-enoic acid;hydrochloride
InChI:
InChI=1S/C9H9NO2.ClH/c1-7(9(11)12)6-8-2-4-10-5-3-8;/h2-6H,1H3,(H,11,12);1H
InChI Key:
CYLFFUCIFDWCSU-UHFFFAOYSA-N
SMILES:
CC(=Cc1ccncc1)C(=O)O.Cl
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
199.634g/mol
Monoisotopic Mass:
199.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
Properties