Basic information
- CAS
1237-75-8- Standard SMILES
COc1ccccc1NC(=O)c1cc2cc(Br)ccc2cc1O- InChIKey
JIEINYQEXWLMCU-UHFFFAOYSA-N- Molecular formula
- C18H14BrNO3
- Average molar mass
- 372.2 g/mol
- Monoisotopic mass
- 371.01571
Names & identifiers
- Preferred name
- 2-Naphthalenecarboxamide, 7-bromo-3-hydroxy-N-(2-methoxyphenyl)-
- IUPAC
- 7-bromo-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide
- English name
- N-(2,3-Dihydro-2-oxo-1H-benzimidazol-5-yl)-3-hydroxy-2-naphthalenecarboxamide
- Molecular formula
- C18H14BrNO3
- Molecular weight
- 372.21
Names & synonyms
2-Naphthalenecarboxamide, 7-bromo-3-hydroxy-N-(2-methoxyphenyl)-DTXSID3061637RefChem:476497DTXCID3033804Naphthol AS-BI1237-75-87-Bromo-3-hydroxy-N-(2-methoxyphenyl)-2-naphthamideNaphthol AS BI7-bromo-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamideMLS000766261NSC-367089Azoic Coupling Component 45
Show more names
C.I.37566AI3-50089AI 3-50089AI-3-50089CI NO 37566Naphtol AS-BI5-(3-Hydroxy-2-naphtNaphthol AS-BI, 94.0%Naphthol AS-BI (C.I. 37566)
MFCD00004077SMR0005288617-bromo-3-hydroxy-N-(2-methoxyphenyl)-2-naphthalenecarboxamideC.I. 37566(7-bromo-3-hydroxy(2-naphthyl))-N-(2-methoxyphenyl)carboxamideEINECS 214-980-4NSC 367089C.I. AZOIC COUPLING COMPONENT 45
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 419
Physicochemical properties
- Boiling point
- 467.3 · 467.3±40.0 °C(Predicted)
- Density
- 1.544 · 1.544±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 8.42 · 8.42±0.40(Predicted)
- CAS DataBase Reference
- 1237 · 1237-75-8(CAS DataBase Reference)
- FDA UNII
- 2 TG9VZA3M · V2TG9VZA3M
- EPA Substance Registry System
- 2 · 2-Naphthalenecarboxamide, 7-bromo-3-hydroxy-N-(2-methoxyphenyl)- (1237-75-8)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Naphthalenecarboxamide, 7-bromo-3-hydroxy-N-(2-methoxyphenyl)-: INACTIVE
Applications
UsesNaphthol AS-BI is a substrate of β-glucuronidase and produces a bright red effect after staining biological tissues.
Preparation methods
PreparationO-Anisidineand 7-Bromo-3-hydroxy-2-naphthoic acidcondensation
Upstream & downstream products
Upstream raw materials
Suppliers32 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海药诚医药科技合伙企业（有限合伙）400-6181121 18616381138 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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