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Home > Aldehydes > 886503-89-5
886503-89-5 | 2-Hydroxy-5-isopropyl-3-methoxy-benzaldehyde
CAS No: 886503-89-5 Catalog No: AG01EYFK MDL No:
Product Description
Catalog Number:
AG01EYFK
Chemical Name:
2-Hydroxy-5-isopropyl-3-methoxy-benzaldehyde
CAS Number:
886503-89-5
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
IUPAC Name:
2-hydroxy-3-methoxy-5-propan-2-ylbenzaldehyde
InChI:
InChI=1S/C11H14O3/c1-7(2)8-4-9(6-12)11(13)10(5-8)14-3/h4-7,13H,1-3H3
InChI Key:
SRHGPMDPQDFHJB-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1O)C=O)C(C)C
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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