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29571-65-1 | Butanoyl chloride, 2-(1,1-dimethylethyl)-3,3-dimethyl-
CAS No: 29571-65-1 Catalog No: AG002YSX MDL No:
Product Description
Catalog Number:
AG002YSX
Chemical Name:
Butanoyl chloride, 2-(1,1-dimethylethyl)-3,3-dimethyl-
CAS Number:
29571-65-1
Molecular Formula:
C10H19ClO
Molecular Weight:
190.7103
IUPAC Name:
2-tert-butyl-3,3-dimethylbutanoyl chloride
InChI:
InChI=1S/C10H19ClO/c1-9(2,3)7(8(11)12)10(4,5)6/h7H,1-6H3
InChI Key:
CCRJSHUTRBFHHR-UHFFFAOYSA-N
SMILES:
ClC(=O)C(C(C)(C)C)C(C)(C)C
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.112g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.711g/mol
Monoisotopic Mass:
190.112g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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