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10210-17-0 | Benzenepropanol, 4-hydroxy-
CAS No: 10210-17-0 Catalog No: AG0006MG MDL No:MFCD00002953
Product Description
Catalog Number:
AG0006MG
Chemical Name:
Benzenepropanol, 4-hydroxy-
CAS Number:
10210-17-0
Molecular Formula:
C9H12O2
Molecular Weight:
152.1904
MDL Number:
MFCD00002953
IUPAC Name:
4-(3-hydroxypropyl)phenol
InChI:
InChI=1S/C9H12O2/c10-7-1-2-8-3-5-9(11)6-4-8/h3-6,10-11H,1-2,7H2
InChI Key:
NJCVPQRHRKYSAZ-UHFFFAOYSA-N
SMILES:
OCCCc1ccc(cc1)O
EC Number:
233-511-4
UNII:
1DJM7P148S
Properties
Complexity:
95.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
152.193g/mol
Monoisotopic Mass:
152.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Autoradiographic analysis of mouse brain kinin B1 and B2 receptors after closed head trauma and ability of Anatibant mesylate to cross the blood-brain barrier. | Journal of neurotrauma 20060501 |
| Evidence of a new biotransformation pathway of p-coumaric acid into p-hydroxybenzaldehyde in Pycnoporus cinnabarinus. | Applied microbiology and biotechnology 20011201 |
| Potent inhibition of CYP2D6 by haloperidol metabolites: stereoselective inhibition by reduced haloperidol. | British journal of clinical pharmacology 20010101 |
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