Basic information
- CAS
39978-69-3- Standard SMILES
CC(N)CC12CC3CC(CC(C3)C1)C2- InChIKey
IZRZEBNCIWGCDK-UHFFFAOYSA-N- Molecular formula
- C13H23N
- Average molar mass
- 193.33 g/mol
- Monoisotopic mass
- 193.18304974
Overview
structure
Names & identifiers
- Preferred name
- Adamantylamphetamine
- IUPAC
- 1-(1-adamantyl)propan-2-amine
- English name
- 1-(1-adamantyl)propan-2-amine
- Molecular formula
- C13H23N
- Molecular weight
- 193.33
Names & synonyms
Adamantylamphetamine56558-33-92-Amino-1-(adamant-1'-yl)propaneRefChem:1096391-(1-adamantyl)propan-2-amine39978-69-31-(adamantan-1-yl)propan-2-amine1-(1-adamantyl)propan-2-amine hydrochlorideCTK4I2206MFCD02632259SCHEMBL3511587SCHEMBL3511589
Show more names
Ethylamine, 2-(adamantan-1-yl)-1-methyl-[2-(1-adamantyl)-1-methyl-ethyl]amine1-(1-Adamantyl)propan-2-amine AldrichCPR1-(1-adamantyl)propan-2-amine(SALTDATA: FREE)Tricyclo[3.3.1.13,7]decane-1-ethanamine, α-methyl-
Tricyclo[3.3.1.13,7]decane-1-ethanamine,a-methyl-CHEMBL4748478SCHEMBL28779402DTXSID60960474ALBB-007406AKOS000266353AKOS006283950AKOS016345561
Database identifiers
- CAS
39978-69-3、56558-33-9- PubChem CID
- 38375
- DTXSID
DTXSID60960474- ChEMBL
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 192
Physicochemical properties
- 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
- HazardClass
- IRRITANT
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_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers6 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
3 records
Compound notes
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