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Chloromethyl Pivalate

CAT: 0572-TRC-C369675-100GSize: 100 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-C369675-100GSize:100 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
18997-19-8
Synonyms
2,2-Dimethylpropanoic Acid Chloromethyl Ester; Chloromethanol Pivalate; (2,2-Dimethyl-1-oxopropoxy)methyl Chloride; 2,2-Dimethylpropionic Acid Chloromethyl Ester; Chloromethyl 2,2-dimethylpropanoate; Chloromethyl 2,2-Dimethylpropionate; Chloromethyl Pivalate; Chloromethyl Trimethylacetate; Pivaloyloxymethyl Chloride; [(tert-Butylcarbonyl)oxy]methyl Chloride; α,α-Dimethylpropionyloxymethyl Chloride;
Hazard Statement
Flammable liquid and vapour; UN number: UN3272; Packing Group: III
Smiles
CC(C)(C)C(=O)OCCl
Molecular Formula
C6H11ClO2
Molecular Weight
150.6
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Chloromethyl pivalate
CAS Number18997-19-8
PubChem CID87885
IUPAC Namechloromethyl 2,2-dimethylpropanoate
Molecular FormulaC6H11ClO2
Molecular Weight150.60
XLogP2.2
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count9
Formal Charge0
Complexity104
SMILES
CC(C)(C)C(=O)OCCl
InChI
InChI=1S/C6H11ClO2/c1-6(2,3)5(8)9-4-7/h4H2,1-3H3
InChIKey
GGRHYQCXXYLUTL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Chloromethyl pivalate
CAS: 18997-19-8
CID: 87885
Formula: C6H11ClO2
MW: 150.60
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight150.60
XLogP32.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass150.0447573
Monoisotopic Mass150.0447573
Topological Polar Surface Area26.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity104
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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