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7299-58-3

7299-58-3 | 2-Propynoyl chloride, 3-phenyl-

CAS No: 7299-58-3 Catalog No: AG005CYQ MDL No:

Product Description

Catalog Number:
AG005CYQ
Chemical Name:
2-Propynoyl chloride, 3-phenyl-
CAS Number:
7299-58-3
Molecular Formula:
C9H5ClO
Molecular Weight:
164.5884
IUPAC Name:
3-phenylprop-2-ynoyl chloride
InChI:
InChI=1S/C9H5ClO/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H
InChI Key:
BZPHJDQWFRMGER-UHFFFAOYSA-N
SMILES:
ClC(=O)C#Cc1ccccc1

Properties

Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.003g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.588g/mol
Monoisotopic Mass:
164.003g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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