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Home > Aldehydes > 1260790-42-8
1260790-42-8 | Benzaldehyde, 3-chloro-2,5-difluoro-4-hydroxy-
CAS No: 1260790-42-8 Catalog No: AG000RAC MDL No:
Product Description
Catalog Number:
AG000RAC
Chemical Name:
Benzaldehyde, 3-chloro-2,5-difluoro-4-hydroxy-
CAS Number:
1260790-42-8
Molecular Formula:
C7H3ClF2O2
Molecular Weight:
192.5473
IUPAC Name:
3-chloro-2,5-difluoro-4-hydroxybenzaldehyde
InChI:
InChI=1S/C7H3ClF2O2/c8-5-6(10)3(2-11)1-4(9)7(5)12/h1-2,12H
InChI Key:
MLLBTRNXBDIQFE-UHFFFAOYSA-N
SMILES:
O=Cc1cc(F)c(c(c1F)Cl)O
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.979g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.546g/mol
Monoisotopic Mass:
191.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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