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Etilevodopa

Etilevodopa structure

CAS No:
37178-37-3
Formula:
C11H15NO4
Chemical Name:
Etilevodopa
Synonyms:
L-Tyrosine,3-hydroxy-,ethyl ester;L-Dopa ethyl ester;O-Ethyl-DOPA;3-Hydroxy-L-tyrosine ethyl ester;Etilevodopa;Levodopa ethyl ester;3,4-Dihydroxy-L-phenylalanine ethyl ester;(S)-Ethyl 2-amino-3-(3,4-dihydroxyphenyl)propanoate;74985-73-2
Categories:
Organic Chemistry > Amides

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Description

Etilevodopa is a tyrosine derivative.

Etilevodopa Basic Attributes

Molecular Weight：

225.24

Exact Mass：

225.24

UNII：

895X917GYE

HScode：

2922509090

Characteristics

PSA：

92.78000

XLogP3：

1.23100

Density：

1.278±0.06 g/cm3

Boiling Point：

394.2±37.0 °C(Predicted)

Flash Point：

192.2ºC

Refractive Index：

1.581

PKA：

9.67±0.20

Safety Information

wgk germany：

hazard class code：

22-36

safety instructions：

Marks：

Precautionary statement(s)：

P305 + P351 + P338

Hazard Statements：

H302; H319

Drug Information

Drug Indication：

Investigated for use/treatment in parkinson's disease.

MeSH Entry Terms：

etilevodopa

Etilevodopa Use and Manufacturing

Antiparkisonian.

Computed Properties

Molecular Weight:225.24
XLogP3:0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:225.10010796
Monoisotopic Mass:225.10010796
Topological Polar Surface Area:92.8
Heavy Atom Count:16
Complexity:234
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes