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146778-56-5 | Pentanoyl chloride, 2,2,4,4-tetramethyl-3-oxo-
CAS No: 146778-56-5 Catalog No: AG001EAV MDL No:
Product Description
Catalog Number:
AG001EAV
Chemical Name:
Pentanoyl chloride, 2,2,4,4-tetramethyl-3-oxo-
CAS Number:
146778-56-5
Molecular Formula:
C9H15ClO2
Molecular Weight:
190.6672
IUPAC Name:
2,2,4,4-tetramethyl-3-oxopentanoyl chloride
InChI:
InChI=1S/C9H15ClO2/c1-8(2,3)6(11)9(4,5)7(10)12/h1-5H3
InChI Key:
DTSGBDDHXIHXIN-UHFFFAOYSA-N
SMILES:
O=C(C(C(=O)Cl)(C)C)C(C)(C)C
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.076g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.667g/mol
Monoisotopic Mass:
190.076g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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