methyl 5-chloro-2-cyanobenzoate (CAS 439117-38-1) — formula C9H6ClNO2, molecular weight 195.60; category organic chemicals.
| CAS Number | 439117-38-1 |
|---|---|
| Molecular Formula | C9H6ClNO2 |
| Molecular Weight | 195.60 |
| LogP | 3.1 |
| Category | Organic Chemicals |
methyl 5-chloro-2-cyanobenzoate is a carbon-based organic compound with CAS registry number 439117-38-1 and molecular formula C9H6ClNO2 (molecular weight 195.60), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 439117-38-1
Its molecular formula C9H6ClNO2 comprises 9 C, 6 H, 1 Cl, 1 N, 2 O atoms.
Also known as: methyl 5-chloro-2-cyanobenzoate · 5-氯-2-氰基苯甲酸甲酯
Category: organic chemicals
The CAS registry number of methyl 5-chloro-2-cyanobenzoate is 439117-38-1.
Molecular formula C9H6ClNO2, molecular weight 195.60.
It is also registered under: methyl 5-chloro-2-cyanobenzoate, 5-氯-2-氰基苯甲酸甲酯.
Category: Organic Chemicals.
Independent reference data for methyl 5-chloro-2-cyanobenzoate (CAS 439117-38-1), compiled from public chemistry databases.
| CAS Registry Number | 439117-38-1 |
|---|---|
| PubChem CID | 12052442 |
| Molecular formula | C9H6ClNO2 |
| IUPAC name | methyl 5-chloro-2-cyanobenzoate |
| Molecular Weight | 195.60 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 195.0087061 |
| Monoisotopic Mass | 195.0087061 |
| Topological Polar Surface Area | 50.1 |
| Heavy Atom Count | 13 |
METHYL 5-CHLORO-2-CYANOBENZOATE; 439117-38-1; DTXSID80476542; RefChem:356044; DTXCID80427352; 869-361-7; MFCD08234733; Benzoic acid, 5-chloro-2-cyano-, methyl ester; SCHEMBL1308471; AKOS006285498; CS-W022867; FS-3340; MB05674; SY110780; METHYL5-CHLORO-2-CYANOBENZOATE; 5-Chloro-2-cy
| Reported hazard statements | H302 (100%), H312 (100%), H315 (100%), H319 (100%), H332 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
methyl 5-chloro-2-cyanobenzoate · CAS 439117-38-1 · C9H6ClNO2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5-氯-2-氰基苯甲酸甲酯