Isobutyraldehyde-2,4-DNPH solution

CAT: 0024-sc-257625Size: 1 mLDry Ice: NoHazardous: No

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CAT#:0024-sc-257625Size:1 mL

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CAS Number

2057-82-1

Chemical Information

Isobutyraldehyde 2,4-Dinitrophenylhydrazone

CAS Number	2057-82-1
PubChem CID	9568083
IUPAC Name	N-[(E)-2-methylpropylideneamino]-2,4-dinitroaniline
Molecular Formula	C10H12N4O4
Molecular Weight	252.23
XLogP	1.9
Topological Polar Surface Area	116
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Heavy Atom Count	18
Formal Charge	0
Complexity	334

SMILES

CC(C)/C=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H12N4O4/c1-7(2)6-11-12-9-4-3-8(13(15)16)5-10(9)14(17)18/h3-7,12H,1-2H3/b11-6+

InChIKey

WYSDOKPZMGYVGI-IZZDOVSWSA-N

Chemical Structure

2D Structure

CAS: 2057-82-1

CID: 9568083

Formula: C10H12N4O4

MW: 252.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	252.23
XLogP3	1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	252.08585488
Monoisotopic Mass	252.08585488
Topological Polar Surface Area	116 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	334
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-257634	Isovaleraldehyde-2,4-DNPH solution
sc-250180	Isobutyraldehyde
sc-257956	P-Tolualdehyde-2,4-DNPH
sc-215614	O-Tolualdehyde 2,4-DNPH
sc-256350	2,5-Dimethylbenzaldehyde-2,4-DNPH
sc-256350A	2,5-Dimethylbenzaldehyde-2,4-DNPH
sc-488332	Isobutyraldehyde-D7
sc-487689	Isobutyraldehyde diethyl acetal
sc-225687	2,4-Dimethoxyphenylmagnesium bromide solution
sc-230956	2,4-Dichlorophenylzinc iodide solution

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1064C 00100	2,4-Dinitrophenylhydrazine Phosphoric Acid Solution
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