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3-Nitrophenyl Heptanoate
[CAS# 56052-18-7]

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CAS#: 56052-18-7
Product: 3-Nitrophenyl Heptanoate
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Identification
Name 3-Nitrophenyl Heptanoate
Synonyms 3-Nitrophenyl heptanoate #
Molecular Structure CAS#: 56052-18-7, 3-Nitrophenyl Heptanoate
Molecular Formula C13H17NO4
Molecular Weight 251.28
CAS Registry Number 56052-18-7
SMILES O=C(Oc1cccc(c1)[N+]([O-])=O)CCCCCC
InChI 1S/C13H17NO4/c1-2-3-4-5-9-13(15)18-12-8-6-7-11(10-12)14(16)17/h6-8,10H,2-5,9H2,1H3
InChIKey AADGXNADXAEBPP-UHFFFAOYSA-N
Properties
Density 1.135g/cm3 (Cal.)
Boiling point 353.051°C at 760 mmHg (Cal.)
Flash point 139.953°C (Cal.)
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