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88552-70-9 | Phenol, 4-[2-[[(4-hydroxyphenyl)methyl]amino]propyl]-
CAS No: 88552-70-9 Catalog No: AG004CP4 MDL No:
Product Description
Catalog Number:
AG004CP4
Chemical Name:
Phenol, 4-[2-[[(4-hydroxyphenyl)methyl]amino]propyl]-
CAS Number:
88552-70-9
Molecular Formula:
C16H19NO2
Molecular Weight:
257.3276
IUPAC Name:
4-[2-[(4-hydroxyphenyl)methylamino]propyl]phenol
InChI:
InChI=1S/C16H19NO2/c1-12(10-13-2-6-15(18)7-3-13)17-11-14-4-8-16(19)9-5-14/h2-9,12,17-19H,10-11H2,1H3
InChI Key:
QMIOJJGNIVHYOJ-UHFFFAOYSA-N
SMILES:
CC(Cc1ccc(cc1)O)NCc1ccc(cc1)O
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.142g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
257.333g/mol
Monoisotopic Mass:
257.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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