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Home > Aldehydes > 960001-61-0
960001-61-0 | BENZALDEHYDE, 2-CHLORO-4-FLUORO-3-HYDROXY-
CAS No: 960001-61-0 Catalog No: AG0069N7 MDL No:MFCD18824352
Product Description
Catalog Number:
AG0069N7
Chemical Name:
BENZALDEHYDE, 2-CHLORO-4-FLUORO-3-HYDROXY-
CAS Number:
960001-61-0
Molecular Formula:
C7H4ClFO2
Molecular Weight:
174.5569
MDL Number:
MFCD18824352
IUPAC Name:
2-chloro-4-fluoro-3-hydroxybenzaldehyde
InChI:
InChI=1S/C7H4ClFO2/c8-6-4(3-10)1-2-5(9)7(6)11/h1-3,11H
InChI Key:
DULDJDNNDZEEJU-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1Cl)O)F
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.988g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.555g/mol
Monoisotopic Mass:
173.988g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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