Basic information
- CAS
5503-32-2- Standard SMILES
ClCC1COC2(CCCCC2)O1- InChIKey
XGQRXAWHKWEULC-UHFFFAOYSA-N- Molecular formula
- C9H15ClO2
- Average molar mass
- 190.67 g/mol
- Monoisotopic mass
- 190.0760574
Names & identifiers
- Preferred name
- 2-(Chloromethyl)-1,4-dioxaspiro[4.5]decane
- IUPAC
- 3-(chloromethyl)-1,4-dioxaspiro[4.5]decane
- English name
- 2,2-Pentamethylene-4-chloromethyl-1,3-dioxolane
- Molecular formula
- C9H15ClO2
- Molecular weight
- 190.67
Names & synonyms
2-(Chloromethyl)-1,4-dioxaspiro[4.5]decane5503-32-23-(chloromethyl)-1,4-dioxaspiro[4.5]decane1, 2-(chloromethyl)-2-(Chloromethyl)-1,4-dioxaspiro(4.5)decaneNSC 45315NSC 41991AI3-31959AI 3-319592,2-Pentamethylene-4-chloromethyl-1,3-dioxolaneSCHEMBL6218973FAA50332
Show more names
1,4-Dioxaspiro[4.5]decane, 2-(chloromethyl)-
NSC41991NSC45315NSC-41991NSC-45315AKOS0158990271-chloro-2,3-O-cyclohexylidenepropaneSB46403SB48100
Database identifiers
- CAS
5503-32-2- PubChem CID
- 97801
- EC Number
- 177-086-2
- Nikkaji
- J2.091.702D
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 155
Physicochemical properties
- Boiling point
- 272 ℃ · 272℃
- Density
- 1.15 · 1.15
- Flash point
- 106 ℃ · 106℃
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers6 total
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
武汉卡米克科技有限公司18162538168 · [email protected]
重庆卡兰医药有限公司[email protected]
JACS-郑州杰克斯化工产品有限公司0371-86259281 13223061139 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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