2-[[4-[Bis(2-chloroethyl)amino]-2-methylphenyl]azo]benzoic acid (CAS 4213-40-5) — formula C18H19Cl2N3O2, molecular weight 380.3; category organic chemicals.
| CAS Number | 4213-40-5 |
|---|---|
| Molecular Formula | C18H19Cl2N3O2 |
| Molecular Weight | 380.3 |
| LogP | 4.9 |
| Category | Organic Chemicals |
2-[[4-[Bis(2-chloroethyl)amino]-2-methylphenyl]azo]benzoic acid is a carbon-based organic compound with CAS registry number 4213-40-5 and molecular formula C18H19Cl2N3O2 (molecular weight 380.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4213-40-5
Its molecular formula C18H19Cl2N3O2 comprises 18 C, 19 H, 2 Cl, 3 N, 2 O atoms.
Also known as: 2-[[4-[Bis(2-chloroethyl)amino]-2-methylphenyl]azo]benzoic acid · 化合物 AI 3-26381
Category: organic chemicals
The CAS registry number of 2-[[4-[Bis(2-chloroethyl)amino]-2-methylphenyl]azo]benzoic acid is 4213-40-5.
Molecular formula C18H19Cl2N3O2, molecular weight 380.3.
It is also registered under: 2-[[4-[Bis(2-chloroethyl)amino]-2-methylphenyl]azo]benzoic acid, 化合物 AI 3-26381.
Category: Organic Chemicals.
Independent reference data for 2-[[4-[Bis(2-chloroethyl)amino]-2-methylphenyl]azo]benzoic acid (CAS 4213-40-5), compiled from public chemistry databases.
| CAS 号 | 4213-40-5 |
|---|---|
| PubChem CID | 20191 |
| 分子式 | C18H19Cl2N3O2 |
| IUPAC 名称 | 2-[[4-[bis(2-chloroethyl)amino]-2-methylphenyl]diazenyl]benzoic acid |
| UNII（FDA） | NL9BFV3XRT |
| Molecular Weight | 380.3 |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 8 |
| Exact Mass | 379.0854322 |
| Monoisotopic Mass | 379.0854322 |
| Topological Polar Surface Area | 65.3 |
| Heavy Atom Count | 25 |
4213-40-5; 2-(2-(4-(Bis(2-chloroethyl)amino)-2-methylphenyl)diazenyl)benzoic acid; 2-[2-[4-[Bis(2-chloroethyl)amino]-2-methylphenyl]diazenyl]benzoic acid; RefChem:1060806; Azo-mustard; Azo Mustard; CB 1414; 2-[[4-[bis(2-chloroethyl)amino]-2-methylphenyl]azo]benzoic acid; NSC-16498; AI 3-26381; 2'-Carboxy-2-methylphenylazo nitrogen mustard; 4-(N,N-Di-2''-chloroethylamino)-2-methyl-2'-carboxyazobenzene; BENZOIC ACID, 2-(4-BIS(2-CHLOROETHYL)AMINO-2-METHYL)PHENYLAZO-; 2'-Carboxy-4-[bis(2-chloroethyl)amino]-2-methylazobenzene; Azobenzene-2-carboxylic acid, 4'-(di-2''-chloroethylamino)-2'-methyl-; Benzoic acid, o-(4-(bis(2-chloroethyl)amino)-o-tolylazo)-
化合物 AI 3-26381 · CAS 4213-40-5 · C18H19Cl2N3O2. UNII NL9BFV3XRT.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 化合物 AI 3-26381