L-Tryptophan, ethyl ester

HCID 81996
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Basic information

CAS
6519-66-0
Standard SMILES
CCOC(=O)[C@@H](N)Cc1c[nH]c2ccccc12
InChIKey
DABYEOZXRSTEGL-NSHDSACASA-N
Molecular formula
C13H16N2O2
Average molar mass
232.28 g/mol
Monoisotopic mass
232.12117776

Names & identifiers

Preferred name
L-Tryptophan, ethyl ester
IUPAC
ethyl (2S)-2-amino-3-(1H-indol-3-yl)propanoate
English name
H-D-TRP-OET HCL
Molecular formula
C13H16N2O2
Molecular weight
232.28

Names & synonyms

Ethyl L-tryptophanate7479-05-2L-Tryptophan, ethyl esterL-Tryptophan ethyl esterTryptophan, ethyl ester, L-DTXSID00884387EINECS 231-285-1RefChem:151972DTXCID701023830231-285-1DABYEOZXRSTEGL-NSHDSACASA-NTryptophan ethyl ester
Show more names
L-Tryptophan ethylTadalafil Impurity 86D-TRYPTOPHAN ETHYL ESTER HYDROCHLORIDEEthyl 2-amino-3-(1H-indol-3-yl)propanoateEthyl2-amino-3-(1H-indol-3-yl)propanoateHCl
ethyl (2S)-2-amino-3-(1H-indol-3-yl)propanoate(S)-Ethyl 2-amino-3-(1H-indol-3-yl)propanoate67645-67-4ethyl tryptophanated-tryptophan ethyl esterDL-Tryptophan, ethyl esterTadalafil Impurity 85Ethyl 2-amino-3-(1H-indol-3-yl)propanoate #

Database identifiers

CAS
6519-66-0、7479-05-2
PubChem CID
81996
DTXSID
DTXSID00884387
ChEMBL
CHEMBL54665
UNII
5G6PMN8WB4
EC Number
231-285-1
Nikkaji
J104.359E

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
68.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
17

Physicochemical properties

Melting point
218 °C · 218 °C
Boiling point
401.2 · 401.2±30.0 °C(Predicted)
Density
1.211 · 1.211±0.06 g/cm3(Predicted)
pka
17.03 · 17.03±0.30(Predicted)
EPA Substance Registry System
L-Tryptophan, ethyl ester (7479-05-2)
TSCA
TSCA listed

Safety & regulation

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationL-Tryptophan, ethyl ester: INACTIVE

Suppliers10 total

Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
湖北扬信医药科技有限公司0714-3999001 19171453112 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]

Related reactions

11 records
New reaction record

Compound notes

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