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104830-08-2,MFCD05663505
Catalog No.:AA003HXV
104830-08-2 | 3-(2-Chloro-pyridin-3-yl)-acrylic acid ethyl ester
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1g
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$475.00   $333.00
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5g
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$1,656.00   $1,159.00
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10g
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$3,179.00   $2,225.00
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Technical Information
Catalog Number:
AA003HXV
Chemical Name:
3-(2-Chloro-pyridin-3-yl)-acrylic acid ethyl ester
CAS Number:
104830-08-2
Molecular Formula:
C10H10ClNO2
Molecular Weight:
211.6449
MDL Number:
MFCD05663505
IUPAC Name:
ethyl (E)-3-(2-chloropyridin-3-yl)prop-2-enoate
InChI:
InChI=1S/C10H10ClNO2/c1-2-14-9(13)6-5-8-4-3-7-12-10(8)11/h3-7H,2H2,1H3/b6-5+
InChI Key:
AXJQCHYUAHBXAK-AATRIKPKSA-N
SMILES:
CCOC(=O)/C=C/c1cccnc1Cl
Properties
Computed Properties
 
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
211.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.645g/mol
Monoisotopic Mass:
211.04g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

Synonyms
 
104830-08-2 
3-(2-Chloro-pyridin-3-yl)-acrylic acid ethyl ester 
SCHEMBL2882460 
DTXSID30445041 
ZINC2547600 
8039AC 
AKOS015838761 
AKOS025293711 
AB21815 
RTR-001044 
148247-84-1 
TR-001044 
MFCD05663505 
ST50826641 
A-5902 
ethyl (2E)-3-(2-chloro(3-pyridyl))prop-2-enoate 
ethyl (2E)-3-(2-chloropyridin-3-yl)prop-2-enoate 
I04-4091 
(E)-3-(2-Chloro-3-pyridyl)acrylic acid ethyl ester 
3-(2-CHLORO-3-PYRIDYL)ACRYLIC ACID ETHYL ESTER 
3-(2-Chloro-pyridin-3-yl)-acrylic acid ethyl ester, AldrichCPR 
C10H10ClNO2 
CID10798563 
ETHYL 3-(2-CHLOROPYRIDIN-3-YL)ACRYLATE 
Ethyl (E)-3-(2-chloropyridin-3-yl)prop-2-enoate 
3-(2-Chloropyridin-3-yl)acrylic acid ethyl ester 
(E)-ETHYL 3-(2-CHLOROPYRIDIN-3-YL)ACRYLATE 
Ethyl 3-(2-chloro-3-pyridyl)acrylate 
PubChem16540 
AC1Q31QB 
AC1Q31Q0 
Literature
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