Basic information
- CAS
1478897-18-5- Standard SMILES
COCCC(C)CCS(=O)(=O)Cl- InChIKey
KHGAAIZYTPPPMH-UHFFFAOYSA-N- Molecular formula
- C7H15ClO3S
- Average molar mass
- 214.71 g/mol
- Monoisotopic mass
- 214.0430432
Names & identifiers
- Preferred name
- 5-Methoxy-3-methylpentane-1-sulfonyl chloride
- IUPAC
- 5-methoxy-3-methylpentane-1-sulfonyl chloride
Names & synonyms
5-methoxy-3-methylpentane-1-sulfonyl chloride1478897-18-5DJC89718AKOS0150041735-methoxy-3-methylpentane-1-sulfonylchlorideEN300-204449
Database identifiers
- CAS
1478897-18-5- PubChem CID
- 65664720
- EC Number
- 170-292-3
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 195
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]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, 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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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