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1379282-27-5 | Benzenamine, 4-(1,1-difluoroethyl)-
CAS No: 1379282-27-5 Catalog No: AG00143H MDL No:MFCD13689207
Product Description
Catalog Number:
AG00143H
Chemical Name:
Benzenamine, 4-(1,1-difluoroethyl)-
CAS Number:
1379282-27-5
Molecular Formula:
C8H9F2N
Molecular Weight:
157.1606
MDL Number:
MFCD13689207
IUPAC Name:
4-(1,1-difluoroethyl)aniline
InChI:
InChI=1S/C8H9F2N/c1-8(9,10)6-2-4-7(11)5-3-6/h2-5H,11H2,1H3
InChI Key:
IHKSZIKBHBCDBK-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)N)(F)F
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.07g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.164g/mol
Monoisotopic Mass:
157.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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