Name: Name:4-(3-aminopropyl)-1,2,5-oxadiazole-3-carboxylic acid 5-oxide
Brand: Angene
SKU: AG00C61O
Rating: 90 (10 reviews)

4-(3-aminopropyl)-1,2,5-oxadiazole-3-carboxylic acid 5-oxide

CAS No.:

352647-66-6

Catalog Number:

AG00C61O

Molecular Formula:

C6H9N3O4

Molecular Weight:

187.1534

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Purity

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Price(USD)

Quantity

95%

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United States

$129

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Catalog Number:

AG00C61O

Chemical Name:

4-(3-aminopropyl)-1,2,5-oxadiazole-3-carboxylic acid 5-oxide

CAS Number:

352647-66-6

Molecular Formula:

C6H9N3O4

Molecular Weight:

187.1534

MDL Number:

MFCD00168548

IUPAC Name:

4-(3-aminopropyl)-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxylic acid

InChI:

InChI=1S/C6H9N3O4/c7-3-1-2-4-5(6(10)11)8-13-9(4)12/h1-3,7H2,(H,10,11)

InChI Key:

ZCXKKBXIVGYOHV-UHFFFAOYSA-N

SMILES:

[O-][n+]1onc(c1CCCN)C(=O)O

Complexity:

189

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

187.059g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

187.155g/mol

Monoisotopic Mass:

187.059g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

115A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-2.7