4,6-bis[(1E)-2-[4-(dimethylamino)phenyl]ethenyl]-2,2-difluoro-2H-1??,3,2-dioxaborinin-1-ylium-2-uide

4,6-bis[(1E)-2-[4-(dimethylamino)phenyl]ethenyl]-2,2-difluoro-2H-1??,3,2-dioxaborinin-1-ylium-2-uide

CAS: 1193447-34-5

Formula: C23H25BF2N2O2

SMILES: CN(C)C1=CC=C(C=CC2=CC(C=CC3=CC=C(C=C3)N(C)C)=[O+][B-](F)(F)O2)C=C1

IUPAC: 4,6-bis[(1E)-2-[4-(dimethylamino)phenyl]ethenyl]-2,2-difluoro-2H-1??,3,2-dioxaborinin-1-ylium-2-uide

InChI: InChI=1S/C23H25BF2N2O2/c1-27(2)20-11-5-18(6-12-20)9-15-22-17-23(30-24(25,26)29-22)16-10-19-7-13-21(14-8-19)28(3)4/h5-17H,1-4H3/b15-9+,16-10+

Composition: C (67.33%), H (6.14%), B (2.63%), F (9.26%), N (6.83%), O (7.80%)

Molar Mass: 410.27

Atom Count: 55

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	410.197714
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	PVXQJYXODFZTBR-KAVGSWPWSA-N
Lipinski's Rule of Five	1
Molar Refractivity	131.56
Topological Polar Surface Area	49.85
Polarizability	43.96
Ring Count	3
Rotatable Bond Count	6

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Molnova Chemicals

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<4 Days	1193447-34-5		$282.06-$1,675.56$282.06$408.95$726.94$1,090.80$1,675.56