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295319-83-4 | Phenol, 3-[2-[(4-chlorophenyl)amino]ethyl]-
CAS No: 295319-83-4 Catalog No: AG002YNS MDL No:MFCD04114500
Product Description
Catalog Number:
AG002YNS
Chemical Name:
Phenol, 3-[2-[(4-chlorophenyl)amino]ethyl]-
CAS Number:
295319-83-4
Molecular Formula:
C14H14ClNO
Molecular Weight:
247.7201
MDL Number:
MFCD04114500
IUPAC Name:
3-[2-(4-chloroanilino)ethyl]phenol
InChI:
InChI=1S/C14H14ClNO/c15-12-4-6-13(7-5-12)16-9-8-11-2-1-3-14(17)10-11/h1-7,10,16-17H,8-9H2
InChI Key:
CFYVQEHNTOXUFJ-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)NCCc1cccc(c1)O
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.076g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
247.722g/mol
Monoisotopic Mass:
247.076g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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