Calcein blue
Properties
- Molecular formula
- C15H15NO7
- Molar mass
- 321.29 g/mol
- Exact mass
- 321.0849 Da
- logP
- 0.78Crippen estimate
- Polar surface area
- 128.3 Ų
- H-bond donors / acceptors
- 3 / 6
- Rotatable bonds
- 6
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
54375-47-2SMILES
Cc1cc(=O)oc2c(CN(CC(=O)O)CC(=O)O)c(O)ccc12InChIKey
RJPSHDMGSVVHFA-UHFFFAOYSA-NInChI
InChI=1S/C15H15NO7/c1-8-4-14(22)23-15-9(8)2-3-11(17)10(15)5-16(6-12(18)19)7-13(20)21/h2-4,17H,5-7H2,1H3,(H,18,19)(H,20,21)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Glycine, N-(carboxymethyl)-N-[(7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-8-yl)methyl]-
- N-(Carboxymethyl)-N-[(7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-8-yl)methyl]glycine
- 4-Methylumbelliferone-8-methyleneiminodiacetic acid
- 2-[Carboxymethyl-[(7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl]amino]acetic acid
Work with Calcein blue
Similar compounds
7,8-Dihydroxy-4-methylcoumarin2107-77-954 % similar
8-Acetyl-7-hydroxy-4-methylcoumarin2555-29-554 % similar
7-(Carboxymethoxy)-4-methylcoumarin64700-15-846 % similar
4-Methylesculetin529-84-043 % similar
4-Methylumbelliferone90-33-539 % similar
DAMC87-01-438 % similar
7-Hydroxycoumarin-4-acetic acid6950-82-937 % similar
N-Benzylaminodiacetic acid3987-53-937 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds