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883311-83-9 molecular structure
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[1-(methoxymethyl)cyclopropyl]methanamine

ChemBase ID: 307989
Molecular Formular: C6H13NO
Molecular Mass: 115.17352
Monoisotopic Mass: 115.09971404
SMILES and InChIs

SMILES:
C1(CC1)(CN)COC
Canonical SMILES:
NCC1(CC1)COC
InChI:
InChI=1S/C6H13NO/c1-8-5-6(4-7)2-3-6/h2-5,7H2,1H3
InChIKey:
GLLBCNNWOPIIOD-UHFFFAOYSA-N

Cite this record

CBID:307989 http://www.chembase.cn/molecule-307989.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
[1-(methoxymethyl)cyclopropyl]methanamine
IUPAC Traditional name
[1-(methoxymethyl)cyclopropyl]methanamine
Synonyms
1-[1-(methoxymethyl)cyclopropyl]methanamine
CAS Number
883311-83-9
MDL Number
MFCD09971227

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
ChemBridge 4026725 external link Add to cart
Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.116581  LogD (pH = 7.4) -2.4445384 
Log P -0.104525395  Molar Refractivity 32.7848 cm3
Polarizability 13.269628 Å3 Polar Surface Area 35.25 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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