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74124-04-2 molecular structure
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O-(cyclopropylmethyl)hydroxylamine hydrochloride

ChemBase ID: 165270
Molecular Formular: C4H10ClNO
Molecular Mass: 123.5813
Monoisotopic Mass: 123.04509163
SMILES and InChIs

SMILES:
C1(CC1)CON.Cl
Canonical SMILES:
NOCC1CC1.Cl
InChI:
InChI=1S/C4H9NO.ClH/c5-6-3-4-1-2-4;/h4H,1-3,5H2;1H
InChIKey:
HMMFZNBOQJOULD-UHFFFAOYSA-N

Cite this record

CBID:165270 http://www.chembase.cn/molecule-165270.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
O-(cyclopropylmethyl)hydroxylamine hydrochloride
IUPAC Traditional name
O-(cyclopropylmethyl)hydroxylamine hydrochloride
Synonyms
Cyclopropylmethoxyamine, Hydrochloride
Cyclopropylmethoxylamine, Hydrochloride
O-Cyclopropylmethyl-hydroxylamine, Hydrochloride
O-(CyclopropylMethyl)hydroxylaMine hydrochloride
CAS Number
74124-04-2
PubChem SID
162259403
PubChem CID
11557279

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 11557279 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.38498294  LogD (pH = 7.4) 0.41760936 
Log P 0.41804162  Molar Refractivity 24.273 cm3
Polarizability 9.589044 Å3 Polar Surface Area 35.25 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
Dimethyl Sulfoxide expand Show data source
Methanol expand Show data source
Water expand Show data source
Apperance
White Solid expand Show data source
Melting Point
170-172°C expand Show data source
Storage Condition
-20°C Freezer expand Show data source
MSDS Link
Download expand Show data source
Purity
97% expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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