Basic information
- CAS
57734-70-0- Standard SMILES
Cc1ccccc1C(O)(c1ccccc1C)C1C[NH+]2CCC1CC2.[Cl-]- InChIKey
WCYWFJOJKZCSAJ-UHFFFAOYSA-N- Molecular formula
- C22H28ClNO
- Average molar mass
- 357.9 g/mol
- Monoisotopic mass
- 357.1859422
Overview
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Names & identifiers
- Preferred name
- 3-Quinuclidinemethanol, alpha,alpha-di-o-tolyl-, hydrochloride
- IUPAC
- 1-azoniabicyclo[2.2.2]octan-3-yl-bis(2-methylphenyl)methanol chloride
- English name
- (3-Quinuclidinyl)di(2-methylphenyl)carbinol hydrochloride dihydrate
- Molecular formula
- C22H32ClNO3
- Molecular weight
- 393.95
Names & synonyms
3-Quinuclidinemethanol, alpha,alpha-di-o-tolyl-, hydrochloride1-azoniabicyclo[2.2.2]octan-3-yl-bis(2-methylphenyl)methanol;chlorideNS00124236bicarfenQC-2MEPHBikarfenBICARPHENSEQUIFENADINE HYDROCHLORIDEQuinuclidin-3-yldi-o-tolylmethanol hydrochloride(quinuclidyl-3)-di-(o-tolyl)carbinolhydrochloridebis-o-tolyl-(3-quinuclidin-1-iumyl)methanol chloridebis-o-tolyl-quinuclidin-1-ium-3-yl-methanol chloride
Show more names
alpha,alpha-di-o-tolyl-3-quinuclidinemethanohydrochloride
Database identifiers
- CAS
57734-70-0- PubChem CID
- 42552
Properties
Computed structural properties
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 406
Physicochemical properties
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 305 T85J01Y · 305T85J01Y
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- HazardClass
- IRRITANT
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers4 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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