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1375069-13-8 | [1,1'-Biphenyl]-3-acetic acid, 3'-[(ethylamino)carbonyl]-
CAS No: 1375069-13-8 Catalog No: AG0013FQ MDL No:MFCD22205795
Product Description
Catalog Number:
AG0013FQ
Chemical Name:
[1,1'-Biphenyl]-3-acetic acid, 3'-[(ethylamino)carbonyl]-
CAS Number:
1375069-13-8
Molecular Formula:
C17H17NO3
Molecular Weight:
283.3218
MDL Number:
MFCD22205795
IUPAC Name:
2-[3-[3-(ethylcarbamoyl)phenyl]phenyl]acetic acid
InChI:
InChI=1S/C17H17NO3/c1-2-18-17(21)15-8-4-7-14(11-15)13-6-3-5-12(9-13)10-16(19)20/h3-9,11H,2,10H2,1H3,(H,18,21)(H,19,20)
InChI Key:
FBFDLRCJKCXOEF-UHFFFAOYSA-N
SMILES:
CCNC(=O)c1cccc(c1)c1cccc(c1)CC(=O)O
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.121g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
283.327g/mol
Monoisotopic Mass:
283.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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