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19071-51-3 | Benzenepropanol, β-[[(4-methylphenyl)methylene]amino]-
CAS No: 19071-51-3 Catalog No: AG002ERD MDL No:
Product Description
Catalog Number:
AG002ERD
Chemical Name:
Benzenepropanol, β-[[(4-methylphenyl)methylene]amino]-
CAS Number:
19071-51-3
Molecular Formula:
C17H19NO
Molecular Weight:
253.3389
IUPAC Name:
2-[(4-methylphenyl)methylideneamino]-3-phenylpropan-1-ol
InChI:
InChI=1S/C17H19NO/c1-14-7-9-16(10-8-14)12-18-17(13-19)11-15-5-3-2-4-6-15/h2-10,12,17,19H,11,13H2,1H3
InChI Key:
DMNGGVDWAASFPT-UHFFFAOYSA-N
SMILES:
OCC(Cc1ccccc1)N=Cc1ccc(cc1)C
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.345g/mol
Monoisotopic Mass:
253.147g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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