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3-Pyridinecarbamic acid, 3-pyridylmethyl ester

HCID 201659
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Basic information

CAS
6507-73-9
Standard SMILES
O=C(Nc1cccnc1)OCc1cccnc1
InChIKey
UYQQTLCAFRGIGI-UHFFFAOYSA-N
Molecular formula
C12H11N3O2
Average molar mass
229.239 g/mol
Monoisotopic mass
229.08512659

Names & identifiers

Preferred name
3-Pyridinecarbamic acid, 3-pyridylmethyl ester
IUPAC
(Pyridin-3-yl)methyl pyridin-3-ylcarbamate
English name
3-Pyridinecarbamic acid 3-pyridylmethyl ester
Molecular formula
C12H11N3O2
Molecular weight
229.23

Names & synonyms

3-Pyridinecarbamic acid 3-pyridylmethyl ester3-Pyridinecarbamic acid, 3-pyridylmethyl ester (7CI,8CI)

Database identifiers

CAS
6507-73-9
PubChem CID
201659
DTXSID
DTXSID70215386
Nikkaji
J66.555J

Properties

Physicochemical properties

Melting point
150 °C · 150 °C
Boiling point
372.6 · 372.6±27.0 °C(Predicted)
Density
1.302 · 1.302±0.06 g/cm3(Predicted)
pka
12.32 · 12.32±0.70(Predicted)

Related reactions

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Compound notes

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