Basic information
- CAS
51501-54-3- Standard SMILES
C1CNC2CCCC2C1- InChIKey
CJNWCWVQGCSQRA-UHFFFAOYSA-N- Molecular formula
- C8H15N
- Average molar mass
- 125.21 g/mol
- Monoisotopic mass
- 125.12044948
Names & identifiers
- Preferred name
- Octahydro-1H-cyclopenta(b)pyridine
- IUPAC
- 2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[b]pyridine
- English name
- octahydro-1H-1-pyrindine
- Molecular formula
- C8H15N
- Molecular weight
- 125.21
Names & synonyms
octahydro-1h-cyclopenta[b]pyridine51501-54-3Octahydro-1H-1-pyrindineDTXSID90965836Octahydro-1H-cyclopenta(b)pyridineRefChem:1093777DTXCID40219977257-245-3Octahydro-[1]pyrindine2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[b]pyridineMFCD09055064EINECS 257-245-3
Show more names
(+-)-trans-octahydro[1]pyrindine1H-Cyclopenta[b]pyridine, octahydro-octahydro-1H-cyclopenta[b]pyridine, Mixture of diastereomers
NSC132840octahydro-1-pyrindineSCHEMBL37822SCHEMBL37823SCHEMBL248969SCHEMBL2307899SCHEMBL2854431CJNWCWVQGCSQRA-UHFFFAOYSA-N
Database identifiers
- CAS
51501-54-3- PubChem CID
- 98448
- DTXSID
DTXSID90965836- EC Number
- 257-245-3
- Nikkaji
- J261.742K
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 101
Physicochemical properties
- Boiling point
- 83 °C · 83 °C(Press: 19 Torr)
- Density
- 0.915 · 0.915±0.06 g/cm3(Predicted)
- pka
- 11.75 · 11.75±0.20(Predicted)
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H335-H314-H227
- Precautionary statements
- 210 · P210-P260-P264-P270-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P370+P378-P403+P233-P403+P235-P405-P501
- HS Code
- 2933399990 · 2933399990
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
Danger
H227 (100%): Combustible liquid [Warning Flammable liquids]
P210, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P370+P378, P403, 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 CategoriesFlam. Liq. 4 (100%)
Safety data
- hs_code
- 2933399990
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H302-H335-H314-H227
- Precautionary statements
- P210-P260-P264-P270-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P370+P378-P403+P233-P403+P235-P405-P501
Chemistry & industry
Suppliers17 total
上海爱孜康医药研究有限公司18721109360 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
上海卡洛化学有限公司21-33526724 18930996265 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
上海会兴生物科技有限公司（安 徽稠环生物科技有限公司）18621295758; 18621295758 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
陕西爱施达尔生物科技有限公司18682931470; 18682931470 · [email protected]
常州探索化学有限公司15295164949 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
上海索本生物科技有限公司13023173052 · [email protected]
上海智乾生物科技有限公司[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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