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776-52-3 | 2,5-Furandione,3-(4-chlorophenyl)dihydro-
CAS No: 776-52-3 Catalog No: AG0058MM MDL No:MFCD16308011
Product Description
Catalog Number:
AG0058MM
Chemical Name:
2,5-Furandione,3-(4-chlorophenyl)dihydro-
CAS Number:
776-52-3
Molecular Formula:
C10H7ClO3
Molecular Weight:
210.6138
MDL Number:
MFCD16308011
IUPAC Name:
3-(4-chlorophenyl)oxolane-2,5-dione
InChI:
InChI=1S/C10H7ClO3/c11-7-3-1-6(2-4-7)8-5-9(12)14-10(8)13/h1-4,8H,5H2
InChI Key:
JKYPBYBOZSIRFW-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)CC1c1ccc(cc1)Cl
NSC Number:
151265
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.008g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.613g/mol
Monoisotopic Mass:
210.008g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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