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1202-39-7 | 2-Propenoic acid, 3-(3,4-dichlorophenyl)-
CAS No: 1202-39-7 Catalog No: AG000QK2 MDL No:MFCD00004385
Product Description
Catalog Number:
AG000QK2
Chemical Name:
2-Propenoic acid, 3-(3,4-dichlorophenyl)-
CAS Number:
1202-39-7
Molecular Formula:
C9H6Cl2O2
Molecular Weight:
217.0487
MDL Number:
MFCD00004385
IUPAC Name:
(E)-3-(3,4-dichlorophenyl)prop-2-enoic acid
InChI:
InChI=1S/C9H6Cl2O2/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5H,(H,12,13)/b4-2+
InChI Key:
RRLUFPHCTSFKNR-DUXPYHPUSA-N
SMILES:
OC(=O)C=Cc1ccc(c(c1)Cl)Cl
EC Number:
214-866-4
UNII:
480625A7SY
NSC Number:
518800
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
215.974g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.045g/mol
Monoisotopic Mass:
215.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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