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Home > Aldehydes > 181035-58-5
181035-58-5 | Benzaldehyde, 4-hydroxy-2-(1-methylethyl)-
CAS No: 181035-58-5 Catalog No: AG0022M3 MDL No:MFCD16997130
Product Description
Catalog Number:
AG0022M3
Chemical Name:
Benzaldehyde, 4-hydroxy-2-(1-methylethyl)-
CAS Number:
181035-58-5
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD16997130
IUPAC Name:
4-hydroxy-2-propan-2-ylbenzaldehyde
InChI:
InChI=1S/C10H12O2/c1-7(2)10-5-9(12)4-3-8(10)6-11/h3-7,12H,1-2H3
InChI Key:
NIAUHSFUZOOBGB-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1C(C)C)O
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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