N-PHTHALOYL-DL-METHIONINE
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N-PHTHALOYL-DL-METHIONINE
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CAS No:
5464-44-8
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Formula:
C13H13NO4S
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Chemical Name:
N-PHTHALOYL-DL-METHIONINE
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Synonyms:
AKOS BBS-00006532;2-(1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)-4-(METHYLTHIO)BUTANOIC ACID;2-(1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)-4-(METHYLSULFANYL)BUTANOIC ACID;TIMTEC-BB SBB001859;PHT-DL-MET-OH;PHTHALYL-DL-METHIONINE;PHTHALOYL-DL-METHIONINE;N-PHTHALOYL-DL-METHIONINE
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CAS No:
Characteristics
100 Ų
1.423±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
102 °C
492.023±40.00 °C(Press: 760.00 Torr)(predicted)
3.454±0.10(predicted)
2-8°C
Safety Information
3
|Warning|H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]|P273, P391, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:279.31
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:279.05652907
Monoisotopic Mass:279.05652907
Topological Polar Surface Area:100
Heavy Atom Count:19
Complexity:374
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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