Home Other Building Blocks 4,5-Difluoro-2-methylindole

4,5-Difluoro-2-methylindole

CAS No.:
85462-60-8
Catalog Number:
AG004JU9
Molecular Formula:
C9H7F2N
Molecular Weight:
167.1554
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Product Description
Catalog Number:
AG004JU9
Chemical Name:
4,5-Difluoro-2-methylindole
CAS Number:
85462-60-8
Molecular Formula:
C9H7F2N
Molecular Weight:
167.1554
MDL Number:
MFCD03839913
IUPAC Name:
4,5-difluoro-2-methyl-1H-indole
InChI:
InChI=1S/C9H7F2N/c1-5-4-6-8(12-5)3-2-7(10)9(6)11/h2-4,12H,1H3
InChI Key:
LTYZOUVRTGPHQM-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1F)cc([nH]2)C
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.055g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.159g/mol
Monoisotopic Mass:
167.055g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties