1,3-bis[3,5-bis(trifluoromethyl)phenyl]urea

1,3-bis[3,5-bis(trifluoromethyl)phenyl]urea

CAS: 3824-74-6

Formula: C17H8F12N2O

SMILES: FC(F)(F)C1=CC(=CC(NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)=C1)C(F)(F)F

IUPAC: 1,3-bis[3,5-bis(trifluoromethyl)phenyl]urea

InChI: InChI=1S/C17H8F12N2O/c18-14(19,20)7-1-8(15(21,22)23)4-11(3-7)30-13(32)31-12-5-9(16(24,25)26)2-10(6-12)17(27,28)29/h1-6H,(H2,30,31,32)

Composition: C (42.17%), H (1.67%), F (47.08%), N (5.79%), O (3.30%)

Molar Mass: 484.245

Atom Count: 40

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	484.044500842
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
InChIKey	YGCOMBKZFUMALE-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	89.95
Topological Polar Surface Area	41.13
Polarizability	30.05
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<10 Days	3824-74-6		Quote Only

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
99%	<5 Days	3824-74-6		$129.88-$2,335.37$129.88$228.24$624.20$2,335.37