4,5,6,7-tetrabromo-2-cresolphthalein-3'-methyliminodiacetic acid (CAS 85563-15-1) — formula C27H21Br4NO8, molecular weight 807.1; category organic chemicals.
| CAS Number | 85563-15-1 |
|---|---|
| Molecular Formula | C27H21Br4NO8 |
| Molecular Weight | 807.1 |
| LogP | 4.1 |
| Category | Organic Chemicals |
4,5,6,7-tetrabromo-2-cresolphthalein-3'-methyliminodiacetic acid is a carbon-based organic compound with CAS registry number 85563-15-1 and molecular formula C27H21Br4NO8 (molecular weight 807.1), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 85563-15-1
Its molecular formula C27H21Br4NO8 comprises 27 C, 21 H, 4 Br, 1 N, 8 O atoms.
Also known as: 4,5,6,7-tetrabromo-2-cresolphthalein-3'-methyliminodiacetic acid · 4,5,6,7-四溴-2-甲酚酞-3'-甲基亚氨基二乙酸
Category: organic chemicals
The CAS registry number of 4,5,6,7-tetrabromo-2-cresolphthalein-3'-methyliminodiacetic acid is 85563-15-1.
Molecular formula C27H21Br4NO8, molecular weight 807.1.
It is also registered under: 4,5,6,7-tetrabromo-2-cresolphthalein-3'-methyliminodiacetic acid, 4,5,6,7-四溴-2-甲酚酞-3'-甲基亚氨基二乙酸.
Category: Organic Chemicals.
Independent reference data for 4,5,6,7-tetrabromo-2-cresolphthalein-3'-methyliminodiacetic acid (CAS 85563-15-1), compiled from public chemistry databases.
| CAS 号 | 85563-15-1 |
|---|---|
| PubChem CID | 135057 |
| 分子式 | C27H21Br4NO8 |
| IUPAC 名称 | 2-[carboxymethyl-[[2-hydroxy-3-methyl-5-[4,5,6,7-tetrabromo-1-(4-hydroxy-3-methylphenyl)-3-oxo-2-benzofuran-1-yl]phenyl]methyl]amino]acetic acid |
| Molecular Weight | 807.1 |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 8 |
| Exact Mass | 806.79597 |
| Monoisotopic Mass | 802.80007 |
| Topological Polar Surface Area | 145 |
| Heavy Atom Count | 40 |
85563-15-1; BP-Ida; 4,5,6,7-Tetrabromo-2-cresolphthalein-3'-methyliminodiacetic acid; RefChem:96388; DTXSID601006122; SY346505; G61366
4,5,6,7-四溴-2-甲酚酞-3'-甲基亚氨基二乙酸 · CAS 85563-15-1 · C27H21Br4NO8.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.