Home > Compound List > Compound details
665-66-7 molecular structure
click picture or here to close

adamantan-1-amine hydrochloride

ChemBase ID: 77203
Molecular Formular: C10H18ClN
Molecular Mass: 187.70962
Monoisotopic Mass: 187.11277726
SMILES and InChIs

SMILES:
C12C[C@@H]3CC(C1)CC(C2)(C3)N.Cl
Canonical SMILES:
NC12CC3C[C@@H](C2)CC(C1)C3.Cl
InChI:
InChI=1S/C10H17N.ClH/c11-10-4-7-1-8(5-10)3-9(2-7)6-10;/h7-9H,1-6,11H2;1H/t7-,8?,9?,10?;
InChIKey:
WOLHOYHSEKDWQH-MHYLRVQGSA-N

Cite this record

CBID:77203 http://www.chembase.cn/molecule-77203.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
adamantan-1-amine hydrochloride
IUPAC Traditional name
amantidine hydrochloride
Synonyms
Adamantan-1-amine hydrochloride
1-Aminoadamantane hydrochloride
CAS Number
665-66-7
MDL Number
MFCD00074723
PubChem SID
162042076
PubChem CID
64150

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Apollo Scientific
OR14311 external link Add to cart Please log in.
Data Source Data ID
PubChem 64150 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -1.5643042  LogD (pH = 7.4) -1.3837394 
Log P 1.4659475  Molar Refractivity 45.5356 cm3
Polarizability 18.504875 Å3 Polar Surface Area 26.02 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Bioassay(PubChem)
Melting Point
>300°C expand Show data source
Storage Warning
Harmful/Hygroscopic/Store under Argon expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle