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85231-15-8 | 4-Hydroxy-2,5-dimethylbenzaldehyde
CAS No: 85231-15-8 Catalog No: AG004PUB MDL No:MFCD03411744
Product Description
Catalog Number:
AG004PUB
Chemical Name:
4-Hydroxy-2,5-dimethylbenzaldehyde
CAS Number:
85231-15-8
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
MDL Number:
MFCD03411744
IUPAC Name:
4-hydroxy-2,5-dimethylbenzaldehyde
InChI:
InChI=1S/C9H10O2/c1-6-4-9(11)7(2)3-8(6)5-10/h3-5,11H,1-2H3
InChI Key:
XLIMLVMYIYSMIQ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C)c(cc1C)O
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:
1.8
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