Home Other Building Blocks 2,2-dimethylpent-4-ynoyl chloride

2,2-dimethylpent-4-ynoyl chloride

CAS No.:
131752-83-5
Catalog Number:
AG01B1NX
Molecular Formula:
C7H9ClO
Molecular Weight:
144.5988
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Product Description
Catalog Number:
AG01B1NX
Chemical Name:
2,2-dimethylpent-4-ynoyl chloride
CAS Number:
131752-83-5
Molecular Formula:
C7H9ClO
Molecular Weight:
144.5988
MDL Number:
MFCD25957918
IUPAC Name:
2,2-dimethylpent-4-ynoyl chloride
InChI:
InChI=1S/C7H9ClO/c1-4-5-7(2,3)6(8)9/h1H,5H2,2-3H3
InChI Key:
RBNNFEXMRCJUNW-UHFFFAOYSA-N
SMILES:
C#CCC(C(=O)Cl)(C)C
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.034g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.598g/mol
Monoisotopic Mass:
144.034g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties