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1-(Diazomethyl)-4-nitrobenzene

HCID 88085
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Basic information

CAS
19479-80-2
Standard SMILES
[N-]=[N+]=Cc1ccc([N+](=O)[O-])cc1
InChIKey
MNGYXDOGPIDUNU-UHFFFAOYSA-N
Molecular formula
C7H5N3O2
Average molar mass
163.13 g/mol
Monoisotopic mass
163.03817641

Names & identifiers

Preferred name
1-(Diazomethyl)-4-nitrobenzene
IUPAC
1-(diazomethyl)-4-nitrobenzene

Names & synonyms

1-(Diazomethyl)-4-nitrobenzene19479-80-2EINECS 243-098-2DTXSID80173125RefChem:74667DTXCID1095616243-098-2Benzene, 1-(diazomethyl)-4-nitro-p-nitrophenyldiazomethaneSCHEMBL3156813NS00026349

Database identifiers

CAS
19479-80-2
PubChem CID
88085
DTXSID
DTXSID80173125
EC Number
243-098-2
Nikkaji
J242.829F

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
47.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
209

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