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19881-90-4 | Benzenepropanol, β-[(phenylmethyl)amino]-
CAS No: 19881-90-4 Catalog No: AG002BQM MDL No:
Product Description
Catalog Number:
AG002BQM
Chemical Name:
Benzenepropanol, β-[(phenylmethyl)amino]-
CAS Number:
19881-90-4
Molecular Formula:
C16H19NO
Molecular Weight:
241.3282
IUPAC Name:
2-(benzylamino)-3-phenylpropan-1-ol
InChI:
InChI=1S/C16H19NO/c18-13-16(11-14-7-3-1-4-8-14)17-12-15-9-5-2-6-10-15/h1-10,16-18H,11-13H2
InChI Key:
LHXDBXYWIPUULZ-UHFFFAOYSA-N
SMILES:
OCC(Cc1ccccc1)NCc1ccccc1
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.147g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
241.334g/mol
Monoisotopic Mass:
241.147g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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