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Home > Aldehydes > 131088-02-3
131088-02-3 | Benzaldehyde, 5-chloro-2,4-dihydroxy-
CAS No: 131088-02-3 Catalog No: AG000VIK MDL No:MFCD18324145
Product Description
Catalog Number:
AG000VIK
Chemical Name:
Benzaldehyde, 5-chloro-2,4-dihydroxy-
CAS Number:
131088-02-3
Molecular Formula:
C7H5ClO3
Molecular Weight:
172.5658
MDL Number:
MFCD18324145
IUPAC Name:
5-chloro-2,4-dihydroxybenzaldehyde
InChI:
InChI=1S/C7H5ClO3/c8-5-1-4(3-9)6(10)2-7(5)11/h1-3,10-11H
InChI Key:
IPOSHVWRFQTHGK-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Cl)c(cc1O)O
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.993g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
172.564g/mol
Monoisotopic Mass:
171.993g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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