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Benzilic acid, 4-(hexyloxy)-, 2-(diethylamino)ethyl ester, hydrochloride

HCID 201538
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Basic information

CAS
6192-64-9
Standard SMILES
CCCCCCOc1ccc(C(O)(C(=O)OCCN(CC)CC)c2ccccc2)cc1.Cl
InChIKey
XETLOFNELZCXMX-UHFFFAOYSA-N
Molecular formula
C26H38ClNO4
Average molar mass
464 g/mol
Monoisotopic mass
463.2489364

Names & identifiers

Preferred name
Benzilic acid, 4-(hexyloxy)-, 2-(diethylamino)ethyl ester, hydrochloride
IUPAC
2-(diethylamino)ethyl 2-(4-hexoxyphenyl)-2-hydroxy-2-phenylacetate;hydrochloride

Names & synonyms

BenzilateTopicaine hydrochloride4-(Hexyloxy)benzilic acid 2-(diethylamino)ethyl ester hydrochloridebeta-Diethylaminoethyl p-n-hexyloxybenzilate hydrochloride6192-64-9Benzilic acid, 4-(hexyloxy)-, 2-(diethylamino)ethyl ester, hydrochlorideRefChem:325757DTXSID009774652-(Diethylamino)ethyl [4-(hexyloxy)phenyl](hydroxy)phenylacetate--hydrogen chloride (1/1)2-(Diethylamino)ethyl [4-(hexyloxy)phenyl](hydroxy)(phenyl)acetate--hydrogen chloride (1/1)

Database identifiers

CAS
6192-64-9
PubChem CID
201538
DTXSID
DTXSID00977465

Properties

Computed structural properties

Topological polar surface area
59 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
15
Heavy atoms
32
Formal charge
0
Complexity
482

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Compound notes

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