N'-[(E)-(4-bromophenyl)methylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide

N'-[(E)-(4-bromophenyl)methylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide

Formula: C16H13BrN2O3

SMILES: BrC1=CC=C(C=NNC(=O)C2COC3=C(O2)C=CC=C3)C=C1

IUPAC: N'-[(E)-(4-bromophenyl)methylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide

InChI: InChI=1/C16H13BrN2O3/c17-12-7-5-11(6-8-12)9-18-19-16(20)15-10-21-13-3-1-2-4-14(13)22-15/h1-9,15H,10H2,(H,19,20)/b18-9+

Composition: C (53.21%), H (3.63%), Br (22.12%), N (7.76%), O (13.29%)

Molar Mass: 361.195

Atom Count: 35

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	360.010955
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	OUTOQWKQEXJRTA-GIJQJNRQNA-N
Lipinski's Rule of Five	1
Molar Refractivity	85.39
Topological Polar Surface Area	59.92
Polarizability	32.66
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H13BrN2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00