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Carbonochloridic acid, C,C'-(1,4-cyclohexanediylbis(methylene)) ester

HCID 76208
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
2916-24-7
Standard SMILES
O=C(Cl)OCC1CCC(COC(=O)Cl)CC1
InChIKey
BTMCUDBTQUAKQH-UHFFFAOYSA-N
Molecular formula
C10H14Cl2O4
Average molar mass
269.12 g/mol
Monoisotopic mass
268.0269143

Names & identifiers

Preferred name
Carbonochloridic acid, C,C'-(1,4-cyclohexanediylbis(methylene)) ester
IUPAC
[4-(carbonochloridoyloxymethyl)cyclohexyl]methyl carbonochloridate
English name
Bis(chloroformic acid)1,4-cyclohexanediylbismethylene ester
Molecular formula
C10H14Cl2O4
Molecular weight
269.12

Names & synonyms

1,4-Cyclohexanebis(methylene chloroformate)Carbonochloridic acid, C,C'-(1,4-cyclohexanediylbis(methylene)) esterCarbonochloridic acid, C,C'-[1,4-cyclohexanediylbis(methylene)] esterRefChem:5745422916-24-7Carbonochloridic acid, 1,4-cyclohexanediylbis(methylene) ester[4-(carbonochloridoyloxymethyl)cyclohexyl]methyl carbonochloridateSCHEMBL2265196DTXSID1062708BTMCUDBTQUAKQH-UHFFFAOYSA-N(Cyclohexane-1,4-diyl)bis(methylene) dicarbonochloridateBis(chloroformic acid)1,4-cyclohexanediylbismethylene ester
Show more names
Dichloridocarbonic acid 1,4-cyclohexanediylbis(methylene) ester

Database identifiers

CAS
2916-24-7

Properties

Computed structural propertiesFilling in

XLogP
3.8
Topological polar surface area
52.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
16
Formal charge
0
Complexity
223

Physicochemical properties

EPA Substance Registry System
1 · Carbonochloridic acid, 1,4-cyclohexanediylbis(methylene) ester (2916-24-7)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
PubChem CID
76208
DTXSID
DTXSID1062708
Nikkaji
J421.642C