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Home > Aldehydes > 1261869-07-1
1261869-07-1 | Benzaldehyde, 2-chloro-3,4-difluoro-
CAS No: 1261869-07-1 Catalog No: AG000S29 MDL No:MFCD18415551
Product Description
Catalog Number:
AG000S29
Chemical Name:
Benzaldehyde, 2-chloro-3,4-difluoro-
CAS Number:
1261869-07-1
Molecular Formula:
C7H3ClF2O
Molecular Weight:
176.5479
MDL Number:
MFCD18415551
IUPAC Name:
2-chloro-3,4-difluorobenzaldehyde
InChI:
InChI=1S/C7H3ClF2O/c8-6-4(3-11)1-2-5(9)7(6)10/h1-3H
InChI Key:
XGJVFMUFGOGDCQ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1Cl)F)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:
175.984g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.547g/mol
Monoisotopic Mass:
175.984g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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