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882489-65-8 molecular structure
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1-cyclopropylcyclopropan-1-amine

ChemBase ID: 284258
Molecular Formular: C6H11N
Molecular Mass: 97.15824
Monoisotopic Mass: 97.08914936
SMILES and InChIs

SMILES:
C1(C2CC2)(CC1)N
Canonical SMILES:
NC1(CC1)C1CC1
InChI:
InChI=1S/C6H11N/c7-6(3-4-6)5-1-2-5/h5H,1-4,7H2
InChIKey:
RTSBJFZXDBBUSI-UHFFFAOYSA-N

Cite this record

CBID:284258 http://www.chembase.cn/molecule-284258.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1-cyclopropylcyclopropan-1-amine
IUPAC Traditional name
1-cyclopropylcyclopropan-1-amine
Synonyms
1-cyclopropylcyclopropan-1-amine
1,1'-bi(cyclopropyl)-1-amine
CAS Number
882489-65-8
MDL Number
MFCD10686557
PubChem SID
180669789
PubChem CID
28064676

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 28064676 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -2.481757  LogD (pH = 7.4) -2.1322215 
Log P 0.54445165  Molar Refractivity 28.9616 cm3
Polarizability 11.859141 Å3 Polar Surface Area 26.02 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Product Information Bioassay(PubChem)
Hydrophobicity(logP)
0.563 expand Show data source
Purity
95% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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