UC-8305
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Basic information
- CAS
2921-31-5- Standard SMILES
CC1OP(=S)(Cl)OC2CCCCC12- InChIKey
HPLOCTDGLFAFAF-UHFFFAOYSA-N- Molecular formula
- C8H14ClO2PS
- Average molar mass
- 240.69 g/mol
- Monoisotopic mass
- 240.0140656
Names & identifiers
- Preferred name
- UC-8305
- IUPAC
- 2-chloro-4-methyl-2-sulfanylidene-4a,5,6,7,8,8a-hexahydro-4H-benzo[d][1,3,2]dioxaphosphinine
- English name
- ENT 23,970
- Molecular formula
- C8H14ClO2PS
- Molecular weight
- 240.69
Names & synonyms
Union carbide UC-8305UC-8305ENT 23,970UC 8305UNII-QLR2KR8883BRN 2558485QLR2KR88832-Chlorohexahydro-4-methyl 4H-1,3,2-benzodioxaphosphorin 2-sulfide3-Phosphabicyclo(4.4.0)decane, P-chloro-2,4-dioxa-5-methyl-P-thiono-DTXSID2041410P-Chloro-2,4-dioxa-5-methyl-P-thiono-3-phosphabicyclo(4.4.0)decane4-06-00-05231 (Beilstein Handbook Reference)
Show more names
UC83052-Chlorohexahydro-4-methyl-4H-1,3,2-benzodioxaphosphorin 2-sulfide
UC-168884H-1,3,2-Benzodioxaphosphorin, 2-chlorohexahydro-4-methyl-, 2-sulfide2-CHLOROHEXAHYDRO-4-METHYL-4H-1,3,2-BENZODIOXAPHOSPHORIN 2-SU...PHOSPHOROCHLORIDOTHIOIC ACID, CYCLIC O,O-(1,2-CYCLOHEXANEDIYLETHYLIDENE) ESTERCYCLOHEXANEMETHANOL, 2-HYDROXY-.ALPHA.-METHYL-, CYCLIC O,O-ESTER WITH PHOSPHOROCHLORIDOTHIOIC ACIDRefChem:203409DTXCID0021410CYCLOHEXANEMETHANOL, 2-HYDROXY-ALPHA-METHYL-, CYCLIC O,O-ESTER WITH PHOSPHOROCHLORIDOTHIOIC ACID
Database identifiers
- CAS
2921-31-5- PubChem CID
- 18023
- DTXSID
DTXSID2041410- UNII
- QLR2KR8883
- Nikkaji
- J13.736G
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- Boiling point
- 293.6 · 293.6±7.0 °C(Predicted)
- Density
- 1.31 · 1.31±0.1 g/cm3(Predicted)
- FDA UNII
- 2 KR8883 · QLR2KR8883
- EPA Substance Registry System
- 2 · 2-Chlorohexahydro-4-methyl 4H-1,3,2-benzodioxaphosphorin 2-sulfide (2921-31-5)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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