5-Bromo-4-chloro-3-indolyl phosphate P-toluidine salt
Properties
- Molecular formula
- C15H15BrClN2O4P
- Molar mass
- 433.62 g/mol
- Exact mass
- 431.9641 Da
- Melting point
- 194–195 °C
- logP
- 4.63Crippen estimate
- Polar surface area
- 108.6 Ų
- H-bond donors / acceptors
- 4 / 3
- Rotatable bonds
- 2
Identifiers
CAS number
6578-06-9SMILES
Cc1ccc(N)cc1.O=P(O)(O)Oc1c[nH]c2ccc(Br)c(Cl)c12InChIKey
QEIFSLUFHRCVQL-UHFFFAOYSA-NInChI
InChI=1S/C8H6BrClNO4P.C7H9N/c9-4-1-2-5-7(8(4)10)6(3-11-5)15-16(12,13)14;1-6-2-4-7(8)5-3-6/h1-3,11H,(H2,12,13,14);2-5H,8H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 1H-Indol-3-ol, 5-bromo-4-chloro-, 3-(dihydrogen phosphate), compd. with 4-methylbenzenamine (1:1)
- Indol-3-ol, 5-bromo-4-chloro-, dihydrogen phosphate (ester), compd. with p-toluidine (1:1)
- 1H-Indol-3-ol, 5-bromo-4-chloro-, dihydrogen phosphate (ester), compd. with 4-methylbenzenamine (1:1)
- Indol-3-ol, 5-bromo-4-chloro-, dihydrogen phosphate, compd. with p-toluidine
- p-Toluidine, compd. with 5-bromo-4-chloroindol-3-ol dihydrogen phosphate (ester) (1:1)
- Benzenamine, 4-methyl-, compd. with 5-bromo-4-chloro-1H-indol-3-yl dihydrogen phosphate (1:1)
- 5-Bromo-4-chloro-3-indolol phosphate mono-p-toluidine salt
Work with 5-Bromo-4-chloro-3-indolyl phosphate P-toluidine salt
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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds