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126030-73-7 | 1H-Indole-3-acetic acid, 5,6-difluoro-
CAS No: 126030-73-7 Catalog No: AG000QS3 MDL No:MFCD09954804
Product Description
Catalog Number:
AG000QS3
Chemical Name:
1H-Indole-3-acetic acid, 5,6-difluoro-
CAS Number:
126030-73-7
Molecular Formula:
C10H7F2NO2
Molecular Weight:
211.1649
MDL Number:
MFCD09954804
IUPAC Name:
2-(5,6-difluoro-1H-indol-3-yl)acetic acid
InChI:
InChI=1S/C10H7F2NO2/c11-7-2-6-5(1-10(14)15)4-13-9(6)3-8(7)12/h2-4,13H,1H2,(H,14,15)
InChI Key:
VZWMUWNMZOYMFC-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c[nH]c2c1cc(F)c(c2)F
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.044g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.168g/mol
Monoisotopic Mass:
211.044g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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