2,4-Pentanedione dioxime

CAT: 0024-sc-397120Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-397120Size:5 mg

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CAS Number

2157-56-4

Chemical Information

2,4-Pentanedione, dioxime

See also: 2,4-Pentanedione dioxime (annotation moved to); 2,4-Pentanedione, 2,4-dioxime (annotation moved to).

CAS Number	2157-56-4
PubChem CID	94762
IUPAC Name	N-(4-hydroxyiminopentan-2-ylidene)hydroxylamine
Molecular Formula	C5H10N2O2
Molecular Weight	130.15
XLogP	0.3
Topological Polar Surface Area	65.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	9
Formal Charge	0
Complexity	124

SMILES

CC(=NO)CC(=NO)C

InChI

InChI=1S/C5H10N2O2/c1-4(6-8)3-5(2)7-9/h8-9H,3H2,1-2H3

InChIKey

WBRYLZHYOFBTPD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2157-56-4

CID: 94762

Formula: C5H10N2O2

MW: 130.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	130.15
XLogP3	0.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	130.074227566
Monoisotopic Mass	130.074227566
Topological Polar Surface Area	65.2 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	124
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	2
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-289229A	3-Phenyl-2,4-pentanedione
sc-231482	3-Benzylidene-2,4-pentanedione
sc-266638	3-Ethoxymethylene-2,4-pentanedione
sc-289229	3-Phenyl-2,4-pentanedione
sc-251987A	3-Chloro-2,4-pentanedione
sc-251987	3-Chloro-2,4-pentanedione
sc-298844	3- (n-Amyl) -2,4-pentanedione
sc-310369	3- (tert-Butyl) -2,4-pentanedione
sc-231942	3,3-Dimethyl-2,4-pentanedione
sc-486746	4,4'-Dibenzoylquinone Dioxime

Catalog	Name
P04075	2,4-Pentanedione dioxime
OR1044250-01	4,4'-Dibenzoylquinone dioxime
OR920023-01	1,4-Benzoquinone dioxime
OR1043791-01	1,2-Cycloheptanedione dioxime
OR22493	3,4-dihydroxycyclobutane-1,2-dione dioxime
C29880-01	1,2-Cycloheptanedione dioxime 99%
C30380-01	1,2-Cyclohexanedione dioxime 94%
1041220 500	Dimethyl Glyoxime (2,3-Butanedione Dioxime)
D3697-30	6,7-Dinitro-2,3-dihydro-benzo[1,4]dioxime
TRC-F596035-100MG	(11Beta,16Alpha)-9-Fluoro-16,17,21-trihydroxyl-pregna-1,4-diene-3,11,20-trione 3,20-Dioxime