Phenacaine Hydrochloride
Basic information
- CAS
620-99-5- Standard SMILES
CCOc1ccc(N=C(C)Nc2ccc(OCC)cc2)cc1.Cl- InChIKey
RRRKUSYYBYVFMC-UHFFFAOYSA-N- Molecular formula
- C18H23ClN2O2
- Average molar mass
- 334.8 g/mol
- Monoisotopic mass
- 334.1448057
Names & identifiers
- Preferred name
- Phenacaine Hydrochloride
- IUPAC
- N,N'-bis(4-ethoxyphenyl)ethanimidamide;hydrochloride
- English name
- Holocaine hydrochloride
- Molecular formula
- C18H23ClN2O2
- Molecular weight
- 334.84
Names & synonyms
Phenacaine hydrochloridePhenacaine hydrochloride anhydrousDTXSID0048769NSC 9293EINECS 210-662-4UNII-2B61HM98KON,N'-Bis(p-ethoxyphenyl)acetamidine hydrochloride2B61HM98KOAcetamidine, N,N'-bis(p-ethoxyphenyl)-, monohydrochlorideDTXCID7028695ACETAMIDINE, N,N'-BIS(p-ETHOXYPHENYL)-, HYDROCHLORIDEEthanimidamide, N,N'-bis(4-ethoxyphenyl)-, monohydrochloride
Show more names
Holocaine hydrochloridenn-bis(p-ethoxyphenyl)acetamidineHClPhenacaine hydrochloride monohydrateN,N'-bis(p-phenetyl)acetamidine hydrochloriden,n’-bis(p-ethoxyphenyl)-acetamidinhydrochlorideN,N'-bis(4-ethoxyphenyl)ethanimidamide hydrochloriden,n’-bis(4-ethoxyphenyl)-ethanimidamidmonohydrochloride
PHENACAINE HYDROCHLORIDE [MI]N,N'-BIS(P-ETHOXYPHENYL)ACETAMIDINE MONOHYDROCHLORIDEN,N'-BIS(4-ETHOXYPHENYL)ETHANIMIDAMIDE MONOHYDROCHLORIDEETHANIMIDAMIDE, N,N'-BIS(4-ETHOXYPHENOL)-, MONOHYDROCHLORIDEN(SUP 1),N(SUP 2)-BIS(P-ETHOXYPHENYL)ACETAMIDINE HYDROCHLORIDEPHENACAINE HYDROCHLORIDE MONOHYDRATE [MI]N,N'-BIS(4-ETHOXYPHENYL)ETHANIMIDAMIDE MONOHYDROCHLORIDE MONOHYDRATEN(SUP 1),N(SUP 2)-BIS(P-ETHOXYPHENYL)ACETAMIDINE HYDROCHLORIDE MONOHYDRATE
Database identifiers
- CAS
620-99-5- PubChem CID
- 12113
- DTXSID
DTXSID0048769- ChEMBL
CHEMBL2107086、CHEMBL3989636- UNII
- 2B61HM98KO
- EC Number
- 210-662-4
Properties
Computed structural properties
- Topological polar surface area
- 42.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 330
Physicochemical properties
- Melting point
- 191 °C · 191°C
- Density
- 1.1434 · 1.1434 (rough estimate)
- refractive index
- 1.54 · 1.5400 (estimate)
- FDA 21 CFR
- 310.545 · 310.545
- FDA UNII
- 2 B61HM98KO · 2B61HM98KO
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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