Butyl Hydrogen Phthalate (CAS 131-70-4) — formula C12H14O4, molecular weight 222.24; category organic chemicals.
| CAS Number | 131-70-4 |
|---|---|
| Molecular Formula | C12H14O4 |
| Molecular Weight | 222.24 |
| Melting Point | 73.5 °C |
| LogP | 3.1 |
| Applications | Uses: This is an endogenously produced metabolite found in the human body. It is used in metabolic reactions, catabolic reactions or waste generation., General Manufacturing Information: 1, 2-Benzenedicarboxylic acid, 1-butyl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Uses: This is an endogenously produced metabolite found in the human body. It is used in metabolic reactions, catabolic reactions or waste generation., General Manufacturing Information: 1, 2-Benzenedicarboxylic acid, 1-butyl ester: ACTIVE.
Butyl Hydrogen Phthalate is a carbon-based organic compound with CAS registry number 131-70-4 and molecular formula C12H14O4 (molecular weight 222.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 131-70-4
Its molecular formula C12H14O4 comprises 12 C, 14 H, 4 O atoms.
Also known as: Butyl Hydrogen Phthalate · 邻苯二甲酸氢丁酯
Category: organic chemicals
The CAS registry number of Butyl Hydrogen Phthalate is 131-70-4.
Molecular formula C12H14O4, molecular weight 222.24.
It is also registered under: Butyl Hydrogen Phthalate, 邻苯二甲酸氢丁酯.
Recorded applications: Uses: This is an endogenously produced metabolite found in the human body. It is used in metabolic reactions, catabolic reactions or waste generation., General Manufacturing Information: 1, 2-Benzenedicarboxylic acid, 1-butyl ester: ACTIVE.
Category: Organic Chemicals.
Independent reference data for Butyl Hydrogen Phthalate (CAS 131-70-4), compiled from public chemistry databases.
| CAS Registry Number | 131-70-4 |
|---|---|
| PubChem CID | 8575 |
| Molecular formula | C12H14O4 |
| IUPAC name | 2-butoxycarbonylbenzoic acid |
| UNII (FDA) | ZI46LWZ45G |
| Molecular Weight | 222.24 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 222.08920892 |
| Monoisotopic Mass | 222.08920892 |
| Topological Polar Surface Area | 63.6 |
| Heavy Atom Count | 16 |
| Melting Point | 73.5 °C |
|---|---|
| Collision Cross Section | 163.94 Ų [M+Na]+ |
| Collision Cross Section | 151.11 Ų [M-H]- |
MONOBUTYL PHTHALATE; 131-70-4; 2-(Butoxycarbonyl)benzoic acid; Butyl hydrogen phthalate; Mono-n-butyl phthalate; Monobutylphthalate; Phthalic acid, monobutyl ester; 1,2-Benzenedicarboxylic acid, monobutyl ester; DTXSID4040002; 1,2-Benzenedicarboxylic acid, 1-butyl ester; ZI46LWZ45G; NSC-8479; DTXCID2020002; RefChem:819272; 205-036-2; 2-butoxycarbonylbenzoic acid
| Reported hazard statements | H360 (97.6%) |
|---|
H360 (97.6%): May damage fertility or the unborn child [Danger Reproductive toxicity]
P203, P280, P318, P405, and P501 (click each P-code to see the statement)
Butyl Hydrogen Phthalate · CAS 131-70-4 · C12H14O4. UNII ZI46LWZ45G. Melting Point: 73.5 °C; Collision Cross Section: 163.94 Ų [M+Na]+; Collision Cross Section: 151.11 Ų [M-H]-.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 邻苯二甲酸氢丁酯