cis-1-N-Boc-3-methyl-isonipecoticacid
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Basic information
- CAS
1207267-93-3- Standard SMILES
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1C(=O)O- InChIKey
ZFQQTPBWJCJGSV-MASDURLHNA-N- Molecular formula
- C12H21NO4
- Average molar mass
- 243.3 g/mol
Names & identifiers
- Preferred name
- cis-1-N-Boc-3-methyl-isonipecoticacid
- English name
- cis-1-N-Boc-3-methyl-isonipecoticacid
- Molecular formula
- C12H21NO4
- Molecular weight
- 243.3
Names & synonyms
cis-1-N-Boc-3-methyl-isonipecoticacidcis-1-Boc-3-methylpiperidine-4-carboxylic Acidcis-1-[(tert-Butoxy)carbonyl]-3-methylpiperidine-4-carboxylic acidrel-1-(1,1-Dimethylethyl) (3R,4R)-3-methyl-1,4-piperidinedicarboxylaterel-(3R,4R)-1-(tert-Butoxycarbonyl)-3-methylpiperidine-4-carboxylic acid(3R,4R)-rel-1-(tert-Butoxycarbonyl)-3-methylpiperidine-4-carboxylic acidcis-1-tert-butoxycarbonyl-3-methyl-piperidine-4-carboxylic acid - [B17473]1,4-PIPERIDINEDICARBOXYLIC ACID, 3-METHYL-, 1-(1,1-DIMETHYLETHYL) ESTER, (3R,4R)-REL-
Database identifiers
- CAS
1207267-93-3- PubChem CID
- 1502006
- EC Number
- 868-960-0
Properties
Physicochemical properties
- Boiling point
- 359.512 · 359.512±35.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.122 · 1.122±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- Store at room temperature
- pka
- 4.573 · 4.573±0.40(predicted)
- Appearance
- White to off-white Solid
- InChI
- InChI=1/C12H21NO4/c1-8-7-13(6-5-9(8)10(14)15)11(16)17-12(2,3)4/h8-9H,5-7H2,1-4H3,(H,14,15)/t8-,9+/s3
- InChIKey
- ZFQQTPBWJCJGSV-MASDURLHNA-N
- SMILES
- N1(C(OC(C)(C)C)=O)CC[C@@H](C(O)=O)[C@@H](C)C1 |&1:10,14,r|
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-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-P280-P301+P312-P302+P352-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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