DL-N-Phenethylaspartic acid

Modify Date: 2025-09-13 16:28:30

DL-N-Phenethylaspartic acid Structure
DL-N-Phenethylaspartic acid structure
Common Name DL-N-Phenethylaspartic acid
CAS Number 5872-49-1 Molecular Weight 237.25200
Density 1.27g/cm3 Boiling Point 398.7ºC at 760 mmHg
Molecular Formula C12H15NO4 Melting Point N/A
MSDS N/A Flash Point 194.9ºC

 Names

Name 2-(2-phenylethylamino)butanedioic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.27g/cm3
Boiling Point 398.7ºC at 760 mmHg
Molecular Formula C12H15NO4
Molecular Weight 237.25200
Flash Point 194.9ºC
Exact Mass 237.10000
PSA 86.63000
LogP 1.13750
Index of Refraction 1.567
InChIKey MUCWEAHFBIHWCX-UHFFFAOYSA-N
SMILES O=C(O)CC(NCCc1ccccc1)C(=O)O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CI9465000
CHEMICAL NAME :
Aspartic acid, N-phenethyl-, DL-
CAS REGISTRY NUMBER :
5872-49-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H15-N-O4
MOLECULAR WEIGHT :
237.28
WISWESSER LINE NOTATION :
QV1YVQM2R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 24,938,1969

 Synonyms

DL-N-Phenethylaspartic acid
ASPARTIC ACID,N-PHENETHYL-,DL
N-(2-phenylethyl)aspartic acid
Acido N-fenetil-DL-aspartico
2-(phenethylamino)butanedioic acid
Acido N-fenetil-DL-aspartico [Italian]
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