Basic information
- Standard SMILES
CC(C)(Oc1ccc(N)cc1)C(=O)O- InChIKey
JTARICLTMYASES-UHFFFAOYSA-N- Molecular formula
- C10H13NO3
- Average molar mass
- 195.21 g/mol
- Monoisotopic mass
- 195.08954328
Names & identifiers
- Preferred name
- 2-(4-Aminophenoxy)-2-methylpropanoic acid
- IUPAC
- 2-(4-aminophenoxy)-2-methylpropanoic acid
- English name
- 2-(4-Aminophenoxy)-2-methylpropionic acid
- Molecular formula
- C10H13NO3
- Molecular weight
- 195.22
Names & synonyms
2-(4-aminophenoxy)-2-methylpropanoic acid117011-70-82-(4-Aminophenoxy)-2-methylpropionic acidPropanoic acid, 2-(4-aminophenoxy)-2-methyl-MFCD000848832-(4-Aminophenoxy)-2-methyl-propanoic acid HCl2-(4-aminophenoxy)-2-methyl-propanoic AcidAB11052-(4-Aminophenoxy)-2-methylpropionicacid4-aminophenoxyisobutyric acidSCHEMBL787522orb3144534
Show more names
2-(4-AMINO-PHENOXY)-2-METHYL-PROPIONIC ACID2-(4-aminophenoxy)-2-methylpropanoic acid hydrochloride
DTXSID60379300JTARICLTMYASES-UHFFFAOYSA-NTYD-03876AKOS0159146782-(4-aminophenoxy)-2-methylpropanoicacidAS-44516SY2393492-(4-aminophenoxy)-2-methyl propionic acid
Database identifiers
- CAS
117011-70-8- PubChem CID
- 2774958
- DTXSID
DTXSID60379300
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 207
Physicochemical properties
- Melting point
- 214 · 214-216 °C (decomp)
- Boiling point
- 364.6 · 364.6±17.0 °C(Predicted)
- Density
- 1.22 · 1.220±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C(protect from light)
- pka
- 3.08 · 3.08±0.10(Predicted)
- Appearance
- Earth-yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H317
- Precautionary statements
- 280 · P280
- Risk Statements
- 43 · 43
- Safety Statements
- 36 · 36/37
- HS Code
- 2922500090 · 2922500090
Safety & regulation
Safety data
- hs_code
- 2922500090
- risk_code
- 43
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 36/37
- Hazard statements
- H302-H317
- Precautionary statements
- P280
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers27 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [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]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
上海马氏化学科技有限公司19916721580 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
成都艾娜华化学制剂有限公司028-86612776; 13699069380 · [email protected]
聿锦（天津）科技有限公司13370351217 kungfu1217@1 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
上海雷祺生物科技有限公司18621609968 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [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]
Alchem Pharmtech,Inc.8485655694 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海锐谱医药科技有限公司15895968936 · [email protected]
山东碳氢生物化工有限公司15508610597 15508610597 · [email protected]
Related reactions
54 records
Linked notes
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