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Home > Pyridines > 1365840-62-5
1365840-62-5 | methyl 3-(pyridin-4-yl)prop-2-enoate hydrochloride
CAS No: 1365840-62-5 Catalog No: AG01A0SS MDL No:MFCD22378778
Product Description
Catalog Number:
AG01A0SS
Chemical Name:
methyl 3-(pyridin-4-yl)prop-2-enoate hydrochloride
CAS Number:
1365840-62-5
Molecular Formula:
C9H10ClNO2
Molecular Weight:
199.6342
MDL Number:
MFCD22378778
IUPAC Name:
methyl (E)-3-pyridin-4-ylprop-2-enoate;hydrochloride
InChI:
InChI=1S/C9H9NO2.ClH/c1-12-9(11)3-2-8-4-6-10-7-5-8;/h2-7H,1H3;1H/b3-2+;
InChI Key:
SBTBVZPAEOOTMS-SQQVDAMQSA-N
SMILES:
COC(=O)C=Cc1ccncc1.Cl
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
199.04g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.634g/mol
Monoisotopic Mass:
199.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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