Basic information
- CAS
17766-59-5- Standard SMILES
O=C(N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)O)OCC1c2ccccc2-c2ccccc21- InChIKey
QNVHCYWPXIGFGN-QFIPXVFZSA-N- Molecular formula
- C24H19Cl2NO4
- Average molar mass
- 456.3 g/mol
- Monoisotopic mass
- 455.06911345
Names & identifiers
- Preferred name
- Fmoc-3,4-dichloro-L-phenylalanine
- IUPAC
- (2S)-3-(3,4-dichlorophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
- English name
- FMOC-3,4-DICHLORO-L-PHENYLALANINE
- Molecular formula
- C13H17ClO4
- Molecular weight
- 272.72
Names & synonyms
Fmoc-3,4-dichloro-L-phenylalanineRefChem:599507810-601-717766-59-5177966-59-5Fmoc-L-3,4-dichlorophe(S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(3,4-dichlorophenyl)propanoic acidMFCD00273473(2S)-3-(3,4-dichlorophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acidL-Phenylalanine, 3,4-dichloro-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-Fmoc-Phe(3,4-Cl2)-OHFmoc-L-3,4-dichloroPhe-OH
Show more names
RARECHEM BK PT 0117FMOC-PHE(M,P-CL2)-OHFMOC-PHE(3,4-DI-CL)-OHFMOC-L-PHE(3,4-CL2)-OHFmoc-L-Phe(3,4-DiCl)-OHFMOC-(3,4-DI-CL)-L-PHE-OHFMOC-L-3,4-DICHLOROPHENYLALANINEN-ALPHA-FMOC-3,4-DICHLORO-L-PHENYLALANINEFMOC-3,4-DICHLORO-L-PHENYLALANINE USP/EP/BP4-Chloro-1-(3,4,5-trimethoxyphenyl)butan-1-one
3,4-Dichloro-L-phenylalanine, N-FMOC protected(Phenylsulphonyl)acetonitrileSCHEMBL1193091-Butanone,4-chloro-1-(3,4,5-trimethoxyphenyl)-SCHEMBL29907959DTXSID109390143,4-DICHLORO-N-[(9H-FLUOREN-9-YLMETHOXY)CARBONYL]-L-PHENYLALANINEAKOS015837332
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 625
Physicochemical properties
- Boiling point
- 390.4 · 390.4±42.0 °C(Predicted)
- Density
- 1.148 · 1.148±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312
- Precautionary statements
- 280 · P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
- HS Code
- 29225090 · 29225090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P280, P301+P317, P302+P352, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- hs_code
- 29225090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Hazard statements
- H302-H312
- Precautionary statements
- P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers72 total
北京华美互利生物化工010-56205725 · [email protected]
江苏吉泰肽业科技有限公司18936337900 18936337900 · [email protected]
湖北威德利化学试剂有限公司186-02735115 18062128043 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海安化生物技术有限公司021-61263375 18168859245
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
深圳虹彩祥根生物科技有限公司+86-0755-89668383 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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