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187410-40-8 | 4-[(2-Hydroxy-phenylamino)-methyl]-phenol
CAS No: 187410-40-8 Catalog No: AG01FBPR MDL No:
Product Description
Catalog Number:
AG01FBPR
Chemical Name:
4-[(2-Hydroxy-phenylamino)-methyl]-phenol
CAS Number:
187410-40-8
Molecular Formula:
C13H13NO2
Molecular Weight:
215.2478
IUPAC Name:
2-[(4-hydroxyphenyl)methylamino]phenol
InChI:
InChI=1S/C13H13NO2/c15-11-7-5-10(6-8-11)9-14-12-3-1-2-4-13(12)16/h1-8,14-16H,9H2
InChI Key:
CUXRKYKPFBCCMM-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)CNc1ccccc1O
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
215.252g/mol
Monoisotopic Mass:
215.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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