Basic information
- CAS
31967-92-7- Standard SMILES
CNC(C)CCC12CC3CC(CC(C3)C1)C2.Cl- InChIKey
FVQFIRWEWAQNBZ-UHFFFAOYSA-N- Molecular formula
- C15H28ClN
- Average molar mass
- 257.84 g/mol
- Monoisotopic mass
- 257.1910276
Names & identifiers
- Preferred name
- 4-(Adamantan-1-yl)-N-methylbutan-2-amine--hydrogen chloride (1/1)
- IUPAC
- 4-(1-adamantyl)-N-methylbutan-2-amine;hydrochloride
- English name
- 1-(3-Methylaminobutyl)adamantane hydrochloride
- Molecular formula
- C15H27N.ClH
- Molecular weight
- 257.84
Names & synonyms
31967-92-7DTXSID909538544-(Adamantan-1-yl)-N-methylbutan-2-amine--hydrogen chloride (1/1)RefChem:1070021DTXCID401381895ADAMANTANE, 1-(3-METHYLAMINOBUTYL)-, HYDROCHLORIDE1-(3-METHYLAMINOBUTYL)ADAMANTANE HYDROCHLORIDE4-(1-adamantyl)-N-methyl-2-butanamine hydrochloride4-(1-adamantyl)-N-methylbutan-2-amine;hydrochloride4-(Adamantan-1-yl)-N-methylbutan-2-amine hydrochloride2-Butylamine, 4-(1-adamantyl)-N-methyl-, hydrochloride
Database identifiers
- CAS
31967-92-7- PubChem CID
- 36025
- DTXSID
DTXSID90953854
Properties
Computed structural properties
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 217
Chemistry & industry
Suppliers2 total
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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