Basic information
- CAS
54788-30-6- Standard SMILES
NC(Cc1ccc(O)c(Br)c1)C(=O)O- InChIKey
HGWOSUKIFQMEIF-UHFFFAOYSA-N- Molecular formula
- C9H10BrNO3
- Average molar mass
- 260.08 g/mol
- Monoisotopic mass
- 258.98441
Overview
3-Bromo-tyrosine is a monocarboxylic acid.
Names & identifiers
- Preferred name
- 3-Bromotyrosine
- IUPAC
- 2-amino-3-(3-bromo-4-hydroxyphenyl)propanoic acid
- English name
- 3-bromotyrosine
- Molecular formula
- C9H10BrNO3
- Molecular weight
- 260.08
Names & synonyms
3-bromotyrosine54788-30-63-Bromo-tyrosineDTXSID309701263-bromo-TyrRefChem:93272DTXCID6013976642-amino-3-(3-bromo-4-hydroxyphenyl)propanoic acid3-Bromo-DL-tyrosineDL-Tyrosine, 3-bromo-MFCD098420612-amino-3-(3-bromo-4-hydroxy-phenyl)propanoic acid
Show more names
Tyrosine, 3-bromo-3-bromotyrosine USP/EP/BP2-Amino-3-(3-bromo-4-hydroxyphenyl)2-Amino-3-(3-bromo-4-hydroxyphenyl)propanoicaci2-Amino-3-(3-bromo-4-hydroxyphenyl)propanoic acid - [A72300]
2-Amino-3-(3-bromo-4-hydroxyphenyl);propanoic acid2-Amino-3-(3-bromo-4-hydroxyphenyl)propanoicacidSCHEMBL455224CHEBI:80911AKOS016009174AS-44315PD078083SY108336
Database identifiers
- CAS
54788-30-6- PubChem CID
- 148708
- DTXSID
DTXSID30970126- ChEBI
CHEBI:80911- Nikkaji
- J3.117.521F
Properties
Computed structural properties
- XLogP
- -1.7
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
Experimental & physicochemical properties
Physical DescriptionSolid
Physicochemical properties
- Boiling point
- 402.8 · 402.8±45.0 °C(Predicted)
- Density
- 1.71 · 1.710±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- 2.21 · 2.21±0.20(Predicted)
- Appearance
- White to off-white Solid
Chemistry & industry
Suppliers25 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
上海芮珊医药科技有限公司02150565560; 17321237488 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
北京珐默兹医药科技有限公司010-80339217; 13331045123 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
北京沃凯生物科技有限公司010-62971590 18548936886 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
Additional notes
DefinitionChEBI: 3-Bromo-tyrosine is a monocarboxylic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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