Methyl hydrogen isophthalate (CAS 1877-71-0) — formula C9H8O4, molecular weight 180.16; category organic chemicals.
| CAS Number | 1877-71-0 |
|---|---|
| Molecular Formula | C9H8O4 |
| Molecular Weight | 180.16 |
| LogP | 1.83 |
| Category | Organic Chemicals |
Methyl hydrogen isophthalate is a carbon-based organic compound with CAS registry number 1877-71-0 and molecular formula C9H8O4 (molecular weight 180.16), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1877-71-0
Its molecular formula C9H8O4 comprises 9 C, 8 H, 4 O atoms.
Also known as: Methyl hydrogen isophthalate · 间苯二甲酸氢甲酯
Category: organic chemicals
The CAS registry number of Methyl hydrogen isophthalate is 1877-71-0.
Molecular formula C9H8O4, molecular weight 180.16.
It is also registered under: Methyl hydrogen isophthalate, 间苯二甲酸氢甲酯.
Category: Organic Chemicals.
Independent reference data for Methyl hydrogen isophthalate (CAS 1877-71-0), compiled from public chemistry databases.
| CAS Registry Number | 1877-71-0 |
|---|---|
| PubChem CID | 601880 |
| Molecular formula | C9H8O4 |
| IUPAC name | 3-methoxycarbonylbenzoic acid |
| UNII (FDA) | 2PQ3SEG88M |
| Molecular Weight | 180.16 |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 180.04225873 |
| Monoisotopic Mass | 180.04225873 |
| Topological Polar Surface Area | 63.6 |
| Heavy Atom Count | 13 |
| LogP | 1.83 |
|---|
3-(Methoxycarbonyl)benzoic acid; 1877-71-0; DTXSID00345100; RefChem:495388; DTXCID10296174; 619-855-1; mono-Methyl isophthalate; Monomethyl isophthalate; Methyl hydrogen isophthalate; 3-methoxycarbonylbenzoic acid; Isophthalic acid monomethyl ester; MFCD00029972; Isophthalic acid, monomethyl ester; methyl 3-carboxybenzoate; 1,3-Benzenedicarboxylic acid, 1-methyl ester; Isophthalic acid, methyl ester
| GHS notification summary | 79.3% (23 / 29) |
|---|
| GHS notification summary | 79.3% (23 / 29) |
|---|---|
| Reported hazard statements | H315 (20.7%), H319 (20.7%), H335 (17.2%) |
This chemical does not meet GHS hazard criteria for 79.3% (23 of 29) of all reports.
H315 (20.7%): Causes skin irritation [Warning Skin corrosion/irritation]
Methyl hydrogen isophthalate · CAS 1877-71-0 · C9H8O4. UNII 2PQ3SEG88M. LogP: 1.83.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 间苯二甲酸氢甲酯