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252286-43-4 | Benzenemethanol, 4-[[[(3,5-dimethylphenyl)methyl]amino]methyl]-
CAS No: 252286-43-4 Catalog No: AG002QYW MDL No:
Product Description
Catalog Number:
AG002QYW
Chemical Name:
Benzenemethanol, 4-[[[(3,5-dimethylphenyl)methyl]amino]methyl]-
CAS Number:
252286-43-4
Molecular Formula:
C17H21NO
Molecular Weight:
255.3547
IUPAC Name:
[4-[[(3,5-dimethylphenyl)methylamino]methyl]phenyl]methanol
InChI:
InChI=1S/C17H21NO/c1-13-7-14(2)9-17(8-13)11-18-10-15-3-5-16(12-19)6-4-15/h3-9,18-19H,10-12H2,1-2H3
InChI Key:
DGXPRZPKQUUUEQ-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1)CNCc1cc(C)cc(c1)C
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.162g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
255.361g/mol
Monoisotopic Mass:
255.162g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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