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84100-52-7 | 3-CHLORO-3-(2-THIENYL)METHACRYLALDEHYDE
CAS No: 84100-52-7 Catalog No: AG004PVX MDL No:
Product Description
Catalog Number:
AG004PVX
Chemical Name:
3-CHLORO-3-(2-THIENYL)METHACRYLALDEHYDE
CAS Number:
84100-52-7
Molecular Formula:
C8H7ClOS
Molecular Weight:
186.6586
IUPAC Name:
(Z)-3-chloro-2-methyl-3-thiophen-2-ylprop-2-enal
InChI:
InChI=1S/C8H7ClOS/c1-6(5-10)8(9)7-3-2-4-11-7/h2-5H,1H3/b8-6-
InChI Key:
DEJITVOMCFNCDM-VURMDHGXSA-N
SMILES:
O=CC(=C(c1cccs1)Cl)C
EC Number:
282-132-0
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
185.991g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.653g/mol
Monoisotopic Mass:
185.991g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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