Benzoic acid,3-(chlorosulfonyl)-, methyl ester (CAS 63555-50-0) — formula C8H7ClO4S, molecular weight 234.66; category organic chemicals.
| CAS Number | 63555-50-0 |
|---|---|
| Molecular Formula | C8H7ClO4S |
| Molecular Weight | 234.66 |
| LogP | 2.2 |
| Applications | General Manufacturing Information: Benzoic acid, 3-(chlorosulfonyl)-, methyl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Benzoic acid, 3-(chlorosulfonyl)-, methyl ester: ACTIVE.
Benzoic acid,3-(chlorosulfonyl)-, methyl ester is a carbon-based organic compound with CAS registry number 63555-50-0 and molecular formula C8H7ClO4S (molecular weight 234.66), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 63555-50-0
Its molecular formula C8H7ClO4S comprises 8 C, 7 H, 1 Cl, 4 O, 1 S atoms.
Also known as: Benzoic acid,3-(chlorosulfonyl)-, methyl ester · 3-(氯磺酰)-苯甲酸甲酯
Category: organic chemicals
The CAS registry number of Benzoic acid,3-(chlorosulfonyl)-, methyl ester is 63555-50-0.
Molecular formula C8H7ClO4S, molecular weight 234.66.
It is also registered under: Benzoic acid,3-(chlorosulfonyl)-, methyl ester, 3-(氯磺酰)-苯甲酸甲酯.
Recorded applications: General Manufacturing Information: Benzoic acid, 3-(chlorosulfonyl)-, methyl ester: ACTIVE.
Category: Organic Chemicals.
Independent reference data for Benzoic acid,3-(chlorosulfonyl)-, methyl ester (CAS 63555-50-0), compiled from public chemistry databases.
| CAS Registry Number | 63555-50-0 |
|---|---|
| PubChem CID | 113339 |
| Molecular formula | C8H7ClO4S |
| IUPAC name | methyl 3-chlorosulfonylbenzoate |
| UNII (FDA) | Z235344799 |
| Molecular Weight | 234.66 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 233.9753576 |
| Monoisotopic Mass | 233.9753576 |
| Topological Polar Surface Area | 68.8 |
| Heavy Atom Count | 14 |
63555-50-0; Benzoic acid, 3-(chlorosulfonyl)-, methyl ester; DTXSID8069935; RefChem:118390; DTXCID6043967; methyl 3-(chlorosulfonyl)benzoate; methyl 3-chlorosulfonylbenzoate; 3-Chlorosulfonyl-benzoic acid methyl ester; MFCD06408800; Methyl 3-(chlorosulphonyl)benzoate; Methyl3-(Chlorosulfonyl)benzoate; 3-chlorosulfonylbenzoic acid methyl ester; SCHEMBL119413; SCHEMBL29457845; Methyl benzoate-3-sulfonyl chloride; SBB098308
| Reported hazard statements | H314 (100%) |
|---|
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Benzoic acid,3-(chlorosulfonyl)-, methyl ester · CAS 63555-50-0 · C8H7ClO4S. UNII Z235344799.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-(氯磺酰)-苯甲酸甲酯