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1666-03-1 | Benzaldehyde, 2-hydroxy-4,5-dimethyl-
CAS No: 1666-03-1 Catalog No: AG001WUP MDL No:MFCD06740693
Product Description
Catalog Number:
AG001WUP
Chemical Name:
Benzaldehyde, 2-hydroxy-4,5-dimethyl-
CAS Number:
1666-03-1
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
MDL Number:
MFCD06740693
IUPAC Name:
2-hydroxy-4,5-dimethylbenzaldehyde
InChI:
InChI=1S/C9H10O2/c1-6-3-8(5-10)9(11)4-7(6)2/h3-5,11H,1-2H3
InChI Key:
PWFKERWVXUISSK-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C)c(cc1O)C
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
150.177g/mol
Monoisotopic Mass:
150.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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