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1,5,5-Trichloro-7-oxabicyclo[4.1.0]heptane

HCID 4416716
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Basic information

CAS
71648-20-9
Standard SMILES
ClC1(Cl)CCCC2(Cl)OC12
InChIKey
AIPINVBKJYKCOI-UHFFFAOYSA-N
Molecular formula
C6H7Cl3O
Average molar mass
201.5 g/mol
Monoisotopic mass
199.956248

Names & identifiers

Preferred name
1,5,5-Trichloro-7-oxabicyclo[4.1.0]heptane
IUPAC
1,5,5-trichloro-7-oxabicyclo[4.1.0]heptane
English name
1,5,5-trichloro-7-oxabicyclo[4.1.0]heptane
Molecular formula
C6H7Cl3O
Molecular weight
201.48

Names & synonyms

71648-20-91,5,5-TRICHLORO-7-OXABICYCLO[4.1.0]HEPTANEEINECS 275-748-61,5,5-Trichloro-7-oxabicyclo(4.1.0)heptaneDTXSID20992216RefChem:73402DTXCID101419285275-748-62,2,6-trichloro-7-oxabicyclo[4.1.0]heptane7-Oxabicyclo[4.1.0]heptane,1,5,5-trichloro-NFU64RH8N9SCHEMBL4465630
Show more names
7-Oxabicyclo[4.1.0]heptane, 1,5,5-trichloro-
AIPINVBKJYKCOI-UHFFFAOYSA-NAKOS024334317NS00061666

Database identifiers

CAS
71648-20-9
PubChem CID
4416716
DTXSID
DTXSID20992216
UNII
NFU64RH8N9
EC Number
275-748-6
Nikkaji
J298.982D

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
12.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
10
Formal charge
0
Complexity
170

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