Basic information
- CAS
13150-40-8- Standard SMILES
CC(C)(O)CN1CCCCC1- InChIKey
SSBJNXYJAHFKJQ-UHFFFAOYSA-N- Molecular formula
- C9H19NO
- Average molar mass
- 157.25 g/mol
- Monoisotopic mass
- 157.14666423
Names & identifiers
- Preferred name
- alpha,alpha-Dimethyl-1-piperidineethanol
- IUPAC
- 2-methyl-1-piperidin-1-ylpropan-2-ol
- English name
- alpha,alpha-dimethylpiperidine-1-ethanol
- Molecular formula
- C9H19NO
- Molecular weight
- 157.25326
Names & synonyms
13150-40-81-Piperidineethanol, alpha,alpha-dimethyl-alpha,alpha-Dimethyl-1-piperidineethanolRefChem:1076389236-092-6alpha,alpha-Dimethylpiperidine-1-ethanol2-methyl-1-(piperidin-1-yl)propan-2-ol2-methyl-1-piperidin-1-ylpropan-2-olSch 1906EINECS 236-092-6BRN 00014475-20-02-00175 (Beilstein Handbook Reference)
Show more names
SCH-1906α,α-Dimethyl-1-piperidineethanol1-Piperidineethanol, α,α-dimethyl-
SCHEMBL3410132SCHEMBL9444446SCHEMBL17421169SCHEMBL28247633DTXSID60927229SSBJNXYJAHFKJQ-UHFFFAOYSA-NMFCD01700706NS00052818
Database identifiers
- CAS
13150-40-8- PubChem CID
- 83183
- DTXSID
DTXSID60927229- EC Number
- 236-092-6
- Nikkaji
- J126.020K
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 117
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Suppliers3 total
河北贝克曼生物科技有限公司15961617865 15961617865 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
佰美济华（河南）医药科技有限公司0371-88900765 18037465274 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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