3-amino-4-chlorobenzoic acid methylester (CAS 40872-87-5) — formula C8H8ClNO2, molecular weight 185.61; category organic chemicals.
| CAS Number | 40872-87-5 |
|---|---|
| Molecular Formula | C8H8ClNO2 |
| Molecular Weight | 185.61 |
| LogP | 2.1 |
| Category | Organic Chemicals |
3-amino-4-chlorobenzoic acid methylester is a carbon-based organic compound with CAS registry number 40872-87-5 and molecular formula C8H8ClNO2 (molecular weight 185.61), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 40872-87-5
Its molecular formula C8H8ClNO2 comprises 8 C, 8 H, 1 Cl, 1 N, 2 O atoms.
Also known as: 3-amino-4-chlorobenzoic acid methylester · 3-氨基-4-氯苯甲酸甲酯
Category: organic chemicals
The CAS registry number of 3-amino-4-chlorobenzoic acid methylester is 40872-87-5.
Molecular formula C8H8ClNO2, molecular weight 185.61.
It is also registered under: 3-amino-4-chlorobenzoic acid methylester, 3-氨基-4-氯苯甲酸甲酯.
Category: Organic Chemicals.
Independent reference data for 3-amino-4-chlorobenzoic acid methylester (CAS 40872-87-5), compiled from public chemistry databases.
| CAS Registry Number | 40872-87-5 |
|---|---|
| PubChem CID | 593055 |
| Molecular formula | C8H8ClNO2 |
| IUPAC name | methyl 3-amino-4-chlorobenzoate |
| UNII (FDA) | GEW7YM92C4 |
| Molecular Weight | 185.61 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 185.0243562 |
| Monoisotopic Mass | 185.0243562 |
| Topological Polar Surface Area | 52.3 |
| Heavy Atom Count | 12 |
Methyl 3-amino-4-chlorobenzoate; 40872-87-5; DTXSID10343910; RefChem:157440; DTXCID40294986; 676-158-5; LOCJPOYKBUUVKU-UHFFFAOYSA-N; 3-Amino-4-chlorobenzoic Acid Methyl Ester; MFCD03470533; 3-Amino-4-Chlorobenzoic Acid Methylester; benzoic acid, 3-amino-4-chloro-, methyl ester; methyl 3-amino-4-chloro-benzoate; Intedanib Impurity 5; METHYL3-AMINO-4-CHLOROBENZOATE; GEW7YM92C4; SCHEMBL51589
| GHS notification summary | 20% (1 / 5) |
|---|
| GHS notification summary | 20% (1 / 5) |
|---|---|
| Reported hazard statements | H302 (20%), H312 (20%), H315 (80%), H319 (80%), H332 (20%), H335 (60%) |
This chemical does not meet GHS hazard criteria for 20% (1 of 5) of reports.
H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral]
3-amino-4-chlorobenzoic acid methylester · CAS 40872-87-5 · C8H8ClNO2. UNII GEW7YM92C4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-氨基-4-氯苯甲酸甲酯