Basic information
- CAS
38404-93-2- Standard SMILES
O=P(O)(O)Oc1c[nH]c2ccc(Br)c(Cl)c12- InChIKey
QRXMUCSWCMTJGU-UHFFFAOYSA-N- Molecular formula
- C8H6BrClNO4P
- Average molar mass
- 326.47 g/mol
- Monoisotopic mass
- 324.89063
Overview
5-bromo-4-chloro-3-indolyl phosphate is an aryl phosphate that is indoxyl phopshate in which the indole moiety is substituted at positions 4 and 5 by chlorine and bromine, respectively. It is used to test for the presence of an enzyme, alkaline phosphatase, which cleaves the phosphate group to give 5-bromo-4-chloroindoxyl, which immediately dimerises to give an intensely blue product. It has a role as a chromogenic compound. It is a member of indoles, an organochlorine compound, an aryl phosphate and an organobromine compound. It is functionally related to an indoxyl.
Names & identifiers
- Preferred name
- 5-Bromo-4-chloro-3-indolyl phosphate
- IUPAC
- (5-bromo-4-chloro-1H-indol-3-yl) dihydrogen phosphate
- English name
- 5-Bromo-4-chloro-3-indolylphosphate
- Molecular formula
- C8H6BrClNO4P
- Molecular weight
- 326.47
Names & synonyms
38404-93-25-Bromo-4-chloro-3-indoxyl phosphate5-Bcip5-Bromo-4-chloro-3-indolyl phosphate5-bromo-4-chloro-1H-indol-3-yl dihydrogen phosphateBZ64NZV99JCHEBI:75508DTXSID401917441H-Indol-3-ol, 5-bromo-4-chloro-, dihydrogen phosphate (ester)RefChem:102171DTXCID80114235(5-bromo-4-chloro-1H-indol-3-yl) dihydrogen phosphate
Show more names
4-Chloro-5-bromo-1H-indole-3-ol phosphoric acid5-Bromo-4-chloro-1H-indol-3-yldihydrogen phosphate5-Bromo-4-chloro-1H-indol-3-ol dihydrogen phosphatePhosphoric acid 4-chloro-5-bromo-1H-indole-3-yl esterPhosphoric acid (4-chloro-5-bromo-1H-indole-3-yl) ester1H-Indol-3-ol, 5-bromo-4-chloro-, 3-(dihydrogen phosphate)
5-Bromo-4-chloro-3-indolylphosphate[(5-bromo-4-chloro-1H-indol-3-yl)oxy]phosphonic acidIndole der.((5-BROMO-4-CHLORO-1H-INDOL-3-YL)OXY)PHOSPHONIC ACIDC8H6BrClNO4PBCIP (FREE BASE)UNII-BZ64NZV99JSCHEMBL23488
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 82.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 314
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Indoles
Physicochemical properties
- FDA UNII
- 64 NZV99J · BZ64NZV99J
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Hazards SummarySee Indole.
Chemistry & industry
Uses & manufacturing
UsesSubstrate for demonstration of activity of alkaline phosphatase. [ChemIDplus]
Suppliers16 total
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
上海孚宇生物科技有限公司18672534757 · [email protected]
上海酶树生物科技有限公司15300487802 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
武汉市恒瑞信泰生物医药科技有限公司027-027-65522215 18163303831 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
Related reactions
2 records
Compound notes
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