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Basic information
- CAS
2629-54-1- Standard SMILES
NC(Cc1cccc(F)c1)C(=O)O- InChIKey
VWHRYODZTDMVSS-UHFFFAOYSA-N- Molecular formula
- C9H10FNO2
- Average molar mass
- 183.18 g/mol
- Monoisotopic mass
- 183.06955672
Names & identifiers
- Preferred name
- 3-Fluorophenylalanine
- IUPAC
- 2-amino-3-(3-fluorophenyl)propanoic acid
- English name
- 3-Fluoro-D-phenylalanine
- Molecular formula
- C9H10FNO2
- Molecular weight
- 183.18
Names & synonyms
456-88-23-FluorophenylalanineDTXSID50941737meta-fluorophenylalanineRefChem:589908DTXCID301370162207-272-13-Fluoro-dl-phenylalanine2629-54-1H-DL-PHE(3-F)-OH2-amino-3-(3-fluorophenyl)propanoic acidm-Fluorophenylalanine
Show more names
D-3-FLUOROPHE3-FLUORO-D-PHEDL-Phe(3-F)-OHH-D-PHE(M-F)-OHDL-3-Fluoro-phe-OHRARECHEM BK PT 0028H-M-FLUORO-D-PHE-OHD-3-FLUOROPHENYLALANINEM-FLUORO-D-PHENYLALANINE
m-Fluoro-dl-phenylalanineDL-Phenylalanine, 3-fluoro-DL-3-FluorophenylalanineAlanine, (3-fluorophenyl)-Phenylalanine, 3-fluoro-MFCD00004273DL-3-(3-Fluorophenyl)alanineAlanine, 3-(m-fluorophenyl)-, DL-
Database identifiers
- CAS
2629-54-1、456-88-2- PubChem CID
- 9976
- DTXSID
DTXSID801365859- ChEMBL
CHEMBL50636- EC Number
- 207-272-1、220-104-1
- Nikkaji
- J55.190B
Properties
Computed structural propertiesFilling in
- XLogP
- -1.9
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Melting point
- 240 °C · ~240 °C (dec.)
- Density
- 1.1939 · 1.1939 (estimate)
- storage temp.
- Store at RT.
- BRN
- 2939807 · 2939807
- CAS DataBase Reference
- 2629 · 2629-54-1(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 312 · H312-H332-H302
- Precautionary statements
- 280 · P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312
- Hazard Codes
- Xi
- Risk Statements
- 37 · 37-24/25
- Safety Statements
- 22 · 22-24/25-37
- RIDADR
- 2811 · UN2811
- WGK Germany
- 3 · 3
- RTECS
- 6300000 · AY6300000
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]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, 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%)；Acute Tox. 4 (100%)；Acute Tox. 4 (100%)
Safety data
- wgk
- 3
- rtecs
- AY6300000
- ridadr
- UN2811
- hs_code
- 29224999
- risk_code
- 37-24/25
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Harmful
- safety_code
- 22-24/25-37
- hazard_class
- 6.1
- packing_group
- III
- Hazard statements
- H312-H332-H302
- Precautionary statements
- P280-P302+P352-P312-P322-P363-P501-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312
Chemistry & industry
Suppliers48 total
北京华美互利生物化工010-56205725 · [email protected]
上海策嵘生物科技有限公司[email protected]
上海哲研生物科技有限公司021-18017610038 18017610038 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [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]
宁波亿诺化学品有限公司86-574-27787657 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [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
深圳虹彩祥根生物科技有限公司+86-0755-89668383 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
Related reactions
9 records
Compound notes
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