Basic information
- CAS
201478-72-0- Standard SMILES
O=CC1CCCN(C(=O)OCc2ccccc2)C1- InChIKey
QKGTVOXHDCVOAW-UHFFFAOYSA-N- Molecular formula
- C14H17NO3
- Average molar mass
- 247.29 g/mol
- Monoisotopic mass
- 247.1208434
Names & identifiers
- Preferred name
- Benzyl 3-formylpiperidine-1-carboxylate
- IUPAC
- benzyl 3-formylpiperidine-1-carboxylate
- English name
- 3-Formyl-piperidine-1-carboxylic acid benzyl ester
- Molecular formula
- C14H17NO3
- Molecular weight
- 247.29
Names & synonyms
201478-72-0Benzyl 3-formylpiperidine-1-carboxylateDTXSID30432552RefChem:328467DTXCID00383380N-CBZ-3-PIPERIDINECARBOXALDEHYDE3-Formyl-piperidine-1-carboxylic acid benzyl esterN-Cbz-3-piperidinylcarboxaldehydeMFCD021790221-PIPERIDINECARBOXYLIC ACID, 3-FORMYL-, PHENYLMETHYL ESTERbenzyl 3-formyl-1-piperidinecarboxylate1-Cbz-3-Piperidinecarboxaldehyde
Show more names
Zinc02577450N-CBZ-3-FORMYLPIPERIDINE1-Cbz-3-forMyl-piperidine1-CBZ-PIPERIDINE-3-ALDEHYDEPiperidine-3-carboxaldehydeBenzyl 3-formylpiperidine-1-carboxylate 97%
3-formyl N-Cbz-piperidineSCHEMBL992822QKGTVOXHDCVOAW-UHFFFAOYSA-N1-benzyloxycarbonyl-3-formylpiperidineAKOS015902248AB109881-Benzyloxycarbonyl-3-formyl piperidineCS-11342
Database identifiers
- CAS
201478-72-0- PubChem CID
- 9899653
- DTXSID
DTXSID30432552- Nikkaji
- J2.861.036J
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 287
Physicochemical properties
- Boiling point
- 384.5 · 384.5±42.0 °C(Predicted)
- Density
- 1 · 1+-.0.06 g/cm3(Predicted)
- storage temp.
- Store at Room Tem.
- pka
- -2.34 · -2.34±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers47 total
常州帝通化工有限公司+86-0519-88298848 · [email protected]
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Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
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PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
北京六合宁远医药科技股份有限公司010-60400365-8001 15910885229 · [email protected]
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Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
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Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
Mainchem Co., Ltd.+86-86-05926210733 · [email protected]
重庆卡兰医药有限公司[email protected]
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Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]
Related reactions
29 records
Compound notes
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