6-Chloro-2-pyridylmethyl nitrate

HCID 146199
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Basic information

CAS
90500-72-4
Standard SMILES
O=[N+]([O-])OCc1cccc(Cl)n1
InChIKey
KLKMRHCMLLGCSZ-UHFFFAOYSA-N
Molecular formula
C6H5ClN2O3
Average molar mass
188.57 g/mol
Monoisotopic mass
187.9988697

Names & identifiers

Preferred name
6-Chloro-2-pyridylmethyl nitrate
IUPAC
(6-chloro-2-pyridinyl)methyl nitrate
English name
6-chloro-2-pyridylmethyl nitrate
Molecular weight
0

Names & synonyms

6-Chloro-2-pyridylmethyl nitrate90500-72-4CPMNDTXSID80238187RefChem:104388DTXCID00160678(6-chloropyridin-2-yl)methyl nitrateFK-803FR-46171SCHEMBL45324602-nitroxymethyl-6-chloropyridineKLKMRHCMLLGCSZ-UHFFFAOYSA-N
Show more names
6-Chloro-2-pyridinemethanol nitrate6-Chloro-2-(nitrooxy)methylpyridine
2-Pyridinemethanol, 6-chloro-, nitrate (ester)

Database identifiers

CAS
90500-72-4
PubChem CID
146199
DTXSID
DTXSID80238187
Nikkaji
J227.606B

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
67.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
12

Related reactions

1 records
New reaction record

Compound notes

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