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Home > Fluorides > 575433-43-1
575433-43-1 | 2-Propynenitrile, 3-(4-fluorophenyl)-
CAS No: 575433-43-1 Catalog No: AG01FN17 MDL No:MFCD25964863
Product Description
Catalog Number:
AG01FN17
Chemical Name:
2-Propynenitrile, 3-(4-fluorophenyl)-
CAS Number:
575433-43-1
Molecular Formula:
C9H4FN
Molecular Weight:
145.1332
MDL Number:
MFCD25964863
IUPAC Name:
3-(4-fluorophenyl)prop-2-ynenitrile
InChI:
InChI=1S/C9H4FN/c10-9-5-3-8(4-6-9)2-1-7-11/h3-6H
InChI Key:
JQGQZJGQARLUAK-UHFFFAOYSA-N
SMILES:
N#CC#Cc1ccc(cc1)F
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.033g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.136g/mol
Monoisotopic Mass:
145.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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