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6283-14-3 molecular structure
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2-cyclohexylcyclohexan-1-amine

ChemBase ID: 111649
Molecular Formular: C12H23N
Molecular Mass: 181.31772
Monoisotopic Mass: 181.18304974
SMILES and InChIs

SMILES:
NC1CCCCC1C1CCCCC1
Canonical SMILES:
NC1CCCCC1C1CCCCC1
InChI:
InChI=1S/C12H23N/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h10-12H,1-9,13H2
InChIKey:
KEHCTKVZDAEDPP-UHFFFAOYSA-N

Cite this record

CBID:111649 http://www.chembase.cn/molecule-111649.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-cyclohexylcyclohexan-1-amine
IUPAC Traditional name
2-cyclohexylcyclohexan-1-amine
Synonyms
o-AMINOBICYCLOHEXYL
CAS Number
6283-14-3
PubChem SID
162090805
PubChem CID
221997

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
MP Biomedicals
05220219 external link Add to cart Please log in.
Data Source Data ID
PubChem 221997 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.11205981  LogD (pH = 7.4) 0.38292193 
Log P 3.1403522  Molar Refractivity 56.555 cm3
Polarizability 22.937813 Å3 Polar Surface Area 26.02 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
MSDS Link
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Certificate of Analysis
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DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05220219 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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