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Basic information
- CAS
136081-84-0- Standard SMILES
O=C1CC2(CCNCC2)Oc2ccccc21- InChIKey
QHNDQKSXDVVXIB-UHFFFAOYSA-N- Molecular formula
- C13H15NO2
- Average molar mass
- 217.26 g/mol
- Monoisotopic mass
- 217.11027872
Names & identifiers
- Preferred name
- Spiro(chroman-2,4'-piperidin)-4-one
- IUPAC
- spiro[3H-chromene-2,4'-piperidine]-4-one
- English name
- Spiro[chromene-2,4'-piperidin]-4(3H)-one
- Molecular formula
- C13H15NO2
- Molecular weight
- 217.26
Names & synonyms
Spiro[chroman-2,4'-piperidin]-4-onespiro(chroman-2,4'-piperidin)-4-oneRefChem:932063136081-84-0spiro[chromene-2,4'-piperidin]-4(3H)-oneSpiro[chromene-2,4'-piperidin]-4-(3H)-onespiro[chromane-2,4'-piperidine]-4-onespiro[3H-chromene-2,4'-piperidine]-4-oneMFCD06738865spiro[chromane-2,4'-piperidin]-4-oneF1923-0043Spiro[chroman-2,4'-piperidine]-4-one
Show more names
Spiro[chroMen-2,4'-piperidin]-4(3H)--oneSpiro[2H-1-benzopyran-2,4'-piperidin]-4(3H)-oneSpiro[Chromene-2,4′-piperidin]-4(3H)-one, CAS 136081-84-0benzyl 4-oxospiro[chromane-2,4'-piperidine]-1'-carboxylate
Spiro[chromene-2,4/'-piperidin]-4(3H)-one3H-spiro[1-benzopyran-2,4'-piperidine]-4-oneSCHEMBL6551543,4-dihydrospiro[1-benzopyran-2,4'-piperidine]-4-oneCHEMBL5431585DTXSID20365981SMSSF-0044377STK694787
Database identifiers
- CAS
136081-84-0- PubChem CID
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 284
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
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
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers18 total
郑州药领医药科技有限公司13526569071 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
上海纳谦化学科技有限公司13598610367 0373-7129549 · [email protected]
台州南峰药物研究所[email protected] 13127117265 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
上海石洋化工有限公司021-56795766 · [email protected]
天津福瑞凯科技有限公司15602163079 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
成都沸柏医药科技有限公司028-84641798 18782128315 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
上海智乾生物科技有限公司[email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
山西诺诚生物科技有限公司17835231871 · [email protected]
Related reactions
3 records
Compound notes
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