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182201-77-0

182201-77-0 Structure

182201-77-0 Structure
IdentificationBack Directory
[Name]

S-((9H-fluoren-9-yl)methyl)-N-((allyloxy)carbonyl)-L-cysteine
[CAS]

182201-77-0
[Synonyms]

Alloc-Cys(Fm)-OH
N-[(Allyloxy)carbonyl]-S-(9H-fluoren-9-ylmethyl)-L-cysteine
S-((9H-fluoren-9-yl)methyl)-N-((allyloxy)carbonyl)-L-cystein
S-((9H-fluoren-9-yl)methyl)-N-((allyloxy)carbonyl)-L-cysteine
L-Cysteine,S-(9H-fluoren-9-ylmethyl)-N-[(2-propenyloxy)carbonyl]-
S-(9H-Fluoren-9-ylmethyl)-N-[(2-propen-1-yloxy)carbonyl]-L-cysteine
L-Cysteine, S-(9H-fluoren-9-ylmethyl)-N-[(2-propen-1-yloxy)carbonyl]-
(R)-3-(((9H-Fluoren-9-yl)methyl)thio)-2-(((allyloxy)carbonyl)amino)propanoic acid
(2R)-3-(9H-fluoren-9-ylmethylsulfanyl)-2-(prop-2-enoxycarbonylamino)propanoic acid
(2S)-3-{[(9H-fluoren-9-yl)methyl]sulfanyl}-2-{[(prop-2-en-1-yloxy)carbonyl]amino}propanoic acid
[Molecular Formula]

C21H21NO4S
[MDL Number]

MFCD30573902
[MOL File]

182201-77-0.mol
[Molecular Weight]

383.46
Chemical PropertiesBack Directory
[Boiling point ]

607.4±55.0 °C(Predicted)
[density ]

1.272±0.06 g/cm3(Predicted)
[pka]

3.50±0.10(Predicted)
[InChI]

InChI=1S/C21H21NO4S/c1-2-11-26-21(25)22-19(20(23)24)13-27-12-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h2-10,18-19H,1,11-13H2,(H,22,25)(H,23,24)/t19-/m0/s1
[InChIKey]

MUSZBDPVJSUUQY-IBGZPJMESA-N
[SMILES]

C(O)(=O)[C@H](CSCC1C2=C(C=CC=C2)C2=C1C=CC=C2)NC(OCC=C)=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P280-P305+P351+P338
Hazard InformationBack Directory
[Uses]

S-(9H-Fluoren-9-ylmethyl)-N-[(2-propen-1-yloxy)carbonyl]-L-cysteine is a useful reactant for the synthesis of Ecteinascidin 743, more commonly known as Trabectedin, an antitumor chemotherapy drug.
Spectrum DetailBack Directory
[Spectrum Detail]

S-((9H-fluoren-9-yl)methyl)-N-((allyloxy)carbonyl)-L-cysteine(182201-77-0)1HNMR
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