Diphenylcarbazone

CAT: 0024-sc-252751Size: 10 gDry Ice: NoHazardous: No

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CAT#:0024-sc-252751Size:10 g

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CAS Number

538-62-5

Chemical Information

1,5-Diphenylcarbazone

See also: Diphenylcarbazone (annotation moved to).

CAS Number	538-62-5
PubChem CID	10860
IUPAC Name	1-anilino-3-phenyliminourea
Molecular Formula	C13H12N4O
Molecular Weight	240.26
XLogP	3.6
Topological Polar Surface Area	65.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	18
Formal Charge	0
Complexity	281

SMILES

C1=CC=C(C=C1)NNC(=O)N=NC2=CC=CC=C2

InChI

InChI=1S/C13H12N4O/c18-13(16-14-11-7-3-1-4-8-11)17-15-12-9-5-2-6-10-12/h1-10,14H,(H,16,18)

InChIKey

ZFWAHZCOKGWUIT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 538-62-5

CID: 10860

Formula: C13H12N4O

MW: 240.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	240.26
XLogP3	3.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	240.10111102
Monoisotopic Mass	240.10111102
Topological Polar Surface Area	65.9 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	281
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

Catalog	Name
sc-202874A	1,5-Diphenylcarbazide
sc-202874	1,5-Diphenylcarbazide
sc-294362A	Diphenycarbazone compound with 1,5 dipenylcarbohydrazide
sc-294362	Diphenycarbazone compound with 1,5 dipenylcarbohydrazide
sc-279977	Phenylazoformic acid 2-phenylhydrazide, compound with 1,5-diphenylcarbazide

Catalog	Name
273159-01	Diphenylcarbazone
237383-01	Diphenylcarbazone ACS
13721-02	s-Diphenylcarbazone
DPC05	Diphenylcarbazone 0.1%
DPC05	Reagecon Diphenylcarbazone Indicator 0.1% Solution
DPCBRBP05	Diphenylcarbazone Bromophenol Blue Mixed Indicator - 500ML
62567-01	1,5-Diphenylcarbazone (mixture with Diphenylcarbazide) extrapure AR, ACS
229158-01	1,5-Diphenylcarbazone compound with 1,5-Diphenylcarbazide ACS
TRC-D487353-5G	1,5-Diphenylcarbazone Compound With 1,5-Diphenylcarbazide (Technical Grade)