Home Other Building Blocks 4-fluoro-3-(1H-pyrrol-1-yl)aniline

4-fluoro-3-(1H-pyrrol-1-yl)aniline

CAS No.:
1178165-14-4
Catalog Number:
AG01AB47
Molecular Formula:
C10H9FN2
Molecular Weight:
176.1903
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Product Description
Catalog Number:
AG01AB47
Chemical Name:
4-fluoro-3-(1H-pyrrol-1-yl)aniline
CAS Number:
1178165-14-4
Molecular Formula:
C10H9FN2
Molecular Weight:
176.1903
MDL Number:
MFCD12165077
IUPAC Name:
4-fluoro-3-pyrrol-1-ylaniline
InChI:
InChI=1S/C10H9FN2/c11-9-4-3-8(12)7-10(9)13-5-1-2-6-13/h1-7H,12H2
InChI Key:
CMCIOSJEJUJJDQ-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)n1cccc1)F
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.075g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.194g/mol
Monoisotopic Mass:
176.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
31A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties