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17951-79-0 | Phenol, 4-[1-methyl-1-[4-(methylamino)phenyl]ethyl]-
CAS No: 17951-79-0 Catalog No: AG00271J MDL No:
Product Description
Catalog Number:
AG00271J
Chemical Name:
Phenol, 4-[1-methyl-1-[4-(methylamino)phenyl]ethyl]-
CAS Number:
17951-79-0
Molecular Formula:
C16H19NO
Molecular Weight:
241.3282
IUPAC Name:
4-[2-[4-(methylamino)phenyl]propan-2-yl]phenol
InChI:
InChI=1S/C16H19NO/c1-16(2,13-6-10-15(18)11-7-13)12-4-8-14(17-3)9-5-12/h4-11,17-18H,1-3H3
InChI Key:
DVQBMNIEJBUJQZ-UHFFFAOYSA-N
SMILES:
CNc1ccc(cc1)C(c1ccc(cc1)O)(C)C
Properties
Complexity:
248
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:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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