Basic information
- CAS
201217-86-9- Standard SMILES
C[C@H](OC(C)(C)C)[C@@H](NC(=O)OC(C)(C)C)C(=O)O- InChIKey
LKRXXARJBFBMCE-DTWKUNHWSA-N- Molecular formula
- C13H25NO5
- Average molar mass
- 275.34 g/mol
- Monoisotopic mass
- 275.1732729
Names & identifiers
- Preferred name
- (2R,3S)-3-(tert-Butoxy)-2-((tert-butoxycarbonyl)amino)butanoic acid
- IUPAC
- (2R,3S)-3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
- English name
- Boc-D-Thr(tBu)-OH
- Molecular formula
- C13H25NO5
- Molecular weight
- 275.34
Names & synonyms
201217-86-9BOC-D-THR(TBU)-OH(2R,3S)-3-(tert-Butoxy)-2-((tert-butoxycarbonyl)amino)butanoic acidBoc-O-tert-butyl-D-threonineMFCD00236876D-Threonine, N-[(1,1-dimethylethoxy)carbonyl]-O-(1,1-dimethylethyl)-(2R,3S)-3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid(2R,3S)-3-(TERT-BUTOXY)-2-[(TERT-BUTOXYCARBONYL)AMINO]BUTANOIC ACIDSCHEMBL8222608BOC-D-THREONINE(TBU)-OHDTXSID80427155BOC-O-T-BUTYL-D-THREONINE
Show more names
3N-BOC-O-tert-Butyl-D-Threonine(Tert-Butoxy)Carbonyl D-Thr(tBu)-OHBoc-O-tert-butyl-D-threonine≥ 98% (HPLC)N-T-BUTOXYCARBONYL-O-T-BUTYL-D-THREONINE
AKOS024259129N-Boc-O-tert-butyl-D-threonine, 95%DS-16108SY127597CS-0158170N-tert-Butoxycarbonyl-O-t.-butyl-D-threonineC73811EN300-1071929
Database identifiers
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 84.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 327
Physicochemical properties
- Boiling point
- 391.3 · 391.3±37.0 °C(Predicted)
- Density
- 1.07 · 1.070±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 3.53 · 3.53±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers51 total
江苏吉泰肽业科技有限公司18936337900 18936337900 · [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]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
山东隆玉达医药科技有限公司0534-2152677 17862520650 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [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
上海相辉医药科技有限公司13761987713 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
吉尔生化（玉门）有限公司18221406464 18221406464;13236395639 · [email protected]
Shanghai Hanhong Scientific Co., Ltd.+undefined17612118332 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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