Home Aldehydes Benzaldehyde, 4-ethynyl-2-fluoro-

Benzaldehyde, 4-ethynyl-2-fluoro-

CAS No.:
1267502-64-6
Catalog Number:
AG000T6U
Molecular Formula:
C9H5FO
Molecular Weight:
148.1338
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Product Description
Catalog Number:
AG000T6U
Chemical Name:
Benzaldehyde, 4-ethynyl-2-fluoro-
CAS Number:
1267502-64-6
Molecular Formula:
C9H5FO
Molecular Weight:
148.1338
MDL Number:
MFCD23703632
IUPAC Name:
4-ethynyl-2-fluorobenzaldehyde
InChI:
InChI=1S/C9H5FO/c1-2-7-3-4-8(6-11)9(10)5-7/h1,3-6H
InChI Key:
SLSHYCVXNLXDGU-UHFFFAOYSA-N
SMILES:
C#Cc1ccc(c(c1)F)C=O
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.032g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.136g/mol
Monoisotopic Mass:
148.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties