N-Propyl Nitrate (Stabilized)

CAT: 0024-sc-477077CSize: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-477077CSize:1 g

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CAS Number

627-13-4

Chemical Information

n-PROPYL NITRATE

N-propyl nitrate appears as a white to straw-colored liquid with an ether-like odor. About the same density as water and insoluble in water. Flash point 70 °F. Vapors heavier than air. Used as a fuel. Shock sensitive. The shock sensitivity is removed by addition of 1-2% of propane, butane, chloroform, ethyl ether, or methyl ether.

CAS Number	627-13-4
PubChem CID	12307
IUPAC Name	propyl nitrate
Molecular Formula	C3H7NO3
Molecular Weight	105.09
XLogP	1.4
Topological Polar Surface Area	55.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	7
Formal Charge	0
Complexity	57

SMILES

CCCO[N+](=O)[O-]

InChI

InChI=1S/C3H7NO3/c1-2-3-7-4(5)6/h2-3H2,1H3

InChIKey

JNTOKFNBDFMTIV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 627-13-4

CID: 12307

Formula: C3H7NO3

MW: 105.09

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	105.09
XLogP3	1.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	105.042593085
Monoisotopic Mass	105.042593085
Topological Polar Surface Area	55.1 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	57.7
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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N-Propyl Nitrate (Stabilized)

Chemical Information

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