Basic information
- CAS
167262-68-2- Standard SMILES
CC(C)(C)OC(=O)N1CCC(C(=O)O)(c2ccccc2)CC1- InChIKey
ZDWOYDIXKYSZPX-UHFFFAOYSA-N- Molecular formula
- C17H23NO4
- Average molar mass
- 305.4 g/mol
- Monoisotopic mass
- 305.16270822
Names & identifiers
- Preferred name
- 1-((Tert-butoxy)carbonyl)-4-phenylpiperidine-4-carboxylic acid
- IUPAC
- 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carboxylic acid
- English name
- BOC-4-PHENYLPIPERIDINE-4-CARBOXYLIC ACID
- Molecular formula
- C17H23NO4
- Molecular weight
- 305.37
Names & synonyms
1-[(tert-butoxy)carbonyl]-4-phenylpiperidine-4-carboxylic acid1-((Tert-butoxy)carbonyl)-4-phenylpiperidine-4-carboxylic acidRefChem:419089818-930-8167262-68-21-(tert-Butoxycarbonyl)-4-phenylpiperidine-4-carboxylic acidBOC-4-PHENYLPIPERIDINE-4-CARBOXYLIC ACID1-(tert-butoxycarbonyl)-4-phenyl-4-piperidinecarboxylic acidMFCD006737741-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carboxylic acidN-Boc-4-phenyl-4-piperidinecarboxylic acid1,4-Piperidinedicarboxylicacid, 4-phenyl-, 1-(1,1-dimethylethyl) ester
Show more names
RARECHEM EM WB 01821-BOC-4-phenylpiperidine-4-carboxylic acid4-phenylpiperidine-1,4-dimate 1-tert-butyl esterBoc-4-phenylpiperidine-4-carboxylic acid≥ 99% (HPLC)4-PHENYL-PIPERIDINE-1,4-DICARBOXYLIC ACID MONO-TERT-BUTYL ESTER1-[[(tert-Butyl)oxy]carbonyl]-4-phenyl-4-piperidinecarboxylic acid
1-tert-Butoxycarbonyl-4-phenyl-piperidine-4-carboxylic acid1-[(tert-butyl)oxycarbonyl]-4-phenylpiperidine-4-carboxylic acidPh-Pip(Boc)-OHOprea1_008795SCHEMBL972474DTXSID10353135ZDWOYDIXKYSZPX-UHFFFAOYSA-NSBB053338
Database identifiers
- CAS
167262-68-2- PubChem CID
- 736917
- DTXSID
DTXSID10353135- EC Number
- 818-930-8
- Nikkaji
- J2.004.507H
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 413
Physicochemical properties
- Melting point
- 187 · 187-189°C
- Boiling point
- 450 · 450.0±45.0 °C(Predicted)
- Density
- 1.176 · 1.176
- storage temp.
- 0 · Store at 0-5°C
- pka
- 4.09 · 4.09±0.20(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HazardClass
- IRRITANT
- HS Code
- 29333990 · 29333990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 29333990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers35 total
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]
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
艾琪康医药科技（上海）有限公司13661411401 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
海济医药科技（苏州）有限公司18012778619 · [email protected]
郑州药领医药科技有限公司13526569071 · [email protected]
江阴安博生物医药有限公司086-010-62176588 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
上海吾沃德化学科技有限公司17721086216
成都叮当时代医药科技有限公司028-86040038 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
江阴康源生物医药科技有限公司0510-86010668 · [email protected]
艾琪康医药科技（上海）有限公司13512160998; 13512160998 · [email protected]
嘉兴市德亿化工有限公司86-0573-85866609 18367600069 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
上海旺珐化工科技有限公司（安徽珐诺伊医药科技有限公司）13918479294 · [email protected]
常州非凡医药科技有限公司0519-82111935 15195055733 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
广州市桐晖药业有限公司020-66392521-118 18922260391 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
济南鑫宏泰化学有限公司13000000000 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
南京一览生物科技有限公司13851808754 · [email protected]
重庆卡兰医药有限公司[email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
Related reactions
34 records
Compound notes
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