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N'-2-Cyclohexen-1-yl-N-methyl-N-nitrosourea

HCID 97566
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
33024-58-7
Standard SMILES
CN(N=O)C(=O)NC1C=CCCC1
InChIKey
XSSLGZDKHDRBIZ-UHFFFAOYSA-N
Molecular formula
C8H13N3O2
Average molar mass
183.21 g/mol
Monoisotopic mass
183.10077667

Names & identifiers

Preferred name
N'-2-Cyclohexen-1-yl-N-methyl-N-nitrosourea
IUPAC
3-cyclohex-2-en-1-yl-1-methyl-1-nitrosourea

Names & synonyms

33024-58-7Urea, 3-(2-cyclohexen-1-yl)-1-methyl-1-nitroso-NSC-1329226N3L6Q4FLHN'-2-Cyclohexen-1-yl-N-methyl-N-nitrosoureaRefChem:1090147NSC 132922BRN 39542913-(2-Cyclohexen-1-yl)-1-methyl-1-nitrosoureaNSC132922Urea, N'-2-cyclohexen-1-yl-N-methyl-N-nitroso-WLN: L6UTJ CMVN1&NO
Show more names
DTXSID7013848743-Cylohex-2-en-1-yl-1-methyl-1-nitrosourea

Database identifiers

CAS
33024-58-7
PubChem CID
97566
DTXSID
DTXSID701384874
UNII
6N3L6Q4FLH

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
61.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
227

Related reactions

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Compound notes

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