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English
1-chloro-2,2-dimethylpropane
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
organic compound
0 references
mass
106.05492803199999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₅H₁₁Cl
0 references
canonical SMILES
CC(C)(C)CCl
0 references
melting point
−20.0
degree Celsius
1 reference
stated in
Jean-Claude Bradley Open Melting Point Dataset
Identifiers
InChI
InChI=1S/C5H11Cl/c1-5(2,3)4-6/h4H2,1-3H3
0 references
InChIKey
JEKYMVBQWWZVHO-UHFFFAOYSA-N
0 references
CAS Registry Number
753-89-9
1 reference
InChIKey
JEKYMVBQWWZVHO-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=753-89-9
ChemSpider ID
12416
0 references
PubChem CID
12956
1 reference
matched by identifier from
InChIKey
InChIKey
JEKYMVBQWWZVHO-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL172298
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JEKYMVBQWWZVHO-UHFFFAOYSA-N
UniChem compound ID
18191723
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID7061069
1 reference
matched by identifier from
InChIKey
InChIKey
JEKYMVBQWWZVHO-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID8047767
0 references
EC number
212-040-8
0 references
ECHA Substance Infocard ID
100.010.946
0 references
AICS Chemical ID (BEING DELETED)
5643
0 references
UNII
J3J2EQV2JR
1 reference
matched by identifier from
InChIKey
InChIKey
JEKYMVBQWWZVHO-UHFFFAOYSA-N
Google Knowledge Graph ID
/g/11fpsdftt9
0 references
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1-Chlor-2,2-dimethylpropan
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