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1233955-57-1 | 3-Fluoro-2-(pyrrolidin-1-yl)aniline
CAS No: 1233955-57-1 Catalog No: AG01FDU5 MDL No:
Product Description
Catalog Number:
AG01FDU5
Chemical Name:
3-Fluoro-2-(pyrrolidin-1-yl)aniline
CAS Number:
1233955-57-1
Molecular Formula:
C10H13FN2
Molecular Weight:
180.2220
IUPAC Name:
3-fluoro-2-pyrrolidin-1-ylaniline
InChI:
InChI=1S/C10H13FN2/c11-8-4-3-5-9(12)10(8)13-6-1-2-7-13/h3-5H,1-2,6-7,12H2
InChI Key:
APCRMNRMOBKKBM-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1N1CCCC1)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:
180.106g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.226g/mol
Monoisotopic Mass:
180.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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