| CAS Number | 1334509-86-2 |
| Catalog Number | AG009Z1Z(AGN-PC-0WA2UM) |
| Chemical Name | (S)-2-(((9H-FLUOREN-9-YL)METHOXY)CARBONYLAMINO)-3-(1-METHYL-1H-INDOL-3-YL)PROPANOIC ACID |
| IUPAC Name | (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(1-methylindol-3-yl)propanoic acid |
| InChI | InChI=1S/C27H24N2O4/c1-29-15-17(18-8-6-7-13-25(18)29)14-24(26(30)31)28-27(32)33-16-23-21-11-4-2-9-19(21)20-10-3-5-12-22(20)23/h2-13,15,23-24H,14,16H2,1H3,(H,28,32)(H,30,31)/t24-/m0/s1 |
| InChI Key | GDPXIUSEXJJUGT-DEOSSOPVSA-N |
| MDL Number | MFCD02684512 |
| Molecular Formula | C27H24N2O4 |
| Molecular Weight | 440.4905 |
| SMILES | O=C(O)[C@H](CC1=CN(C)C2=CC=CC=C12)NC(OCC4C3=C(C5=C4C=CC=C5)C=CC=C3)=O |
| Synonyms | FMOC-TRP(ME)-OH,
1334509-86-2,
(S)-2-(((9H-FLUOREN-9-YL)METHOXY)CARBONYLAMINO)-3-(1-METHYL-1H-INDOL-3-YL)PROPANOIC ACID,
(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(1-methyl-1H-indol-3-yl)propanoic acid,
fmoc-1-methyl-l-tryptophan,
SCHEMBL9081984,
Fmoc-N-alpha-methyl-L-tryptophan,
(S)-2-(9H-Fluoren-9-ylmethoxycarbonylamino)-3-(1-methyl-1H-indol-3-yl)-propionic acid,
ZINC2583099,
MFCD02684512,
AKOS025405219,
ACN-033656,
AS-30010,
SC-50110,
FT-0697570,
X-1478,
Fmoc-Trp(1-Me)-OH,
ACN-055437,
112913-63-0,
(S)-2-(9H-Fluoren-9-ylmethoxycarbonylamino)-3-(1-methyl-1H-indol-3-yl)-propionicacid,
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| Complexity | 692 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 440.174g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 33 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 440.499g/mol |
| Monoisotopic Mass | 440.174g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 80.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.7 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number