BT424

CAT: 0607-BA9019-1Size: 1 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0607-BA9019-1Size:1 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

2755180-37-9

Form

A solid

Molecular Formula

C22H15BCl2N2O2

Molecular Weight

421.08

Shipping Conditions

Blue ice

Storage Conditions

4°C.

Chemical Information

4-(6,8-dichloro-2-phenyl-2H-chromen-3-yl)-2-phenyl-5H-1,3,5,2-oxadiazaborole

CAS Number	2755180-37-9
PubChem CID	168510578
IUPAC Name	4-(6,8-dichloro-2-phenyl-2H-chromen-3-yl)-2-phenyl-5H-1,3,5,2-oxadiazaborole
Molecular Formula	C22H15BCl2N2O2
Molecular Weight	421.1
Topological Polar Surface Area	42.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	29
Formal Charge	0
Complexity	649

SMILES

B1(N=C(NO1)C2=CC3=C(C(=CC(=C3)Cl)Cl)OC2C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C22H15BCl2N2O2/c24-17-11-15-12-18(22-26-23(29-27-22)16-9-5-2-6-10-16)20(14-7-3-1-4-8-14)28-21(15)19(25)13-17/h1-13,20H,(H,26,27)

InChIKey

SYIZHZBXDOQNIR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2755180-37-9

CID: 168510578

Formula: C22H15BCl2N2O2

MW: 421.1

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	421.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	420.0603633
Monoisotopic Mass	420.0603633
Topological Polar Surface Area	42.9 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	649
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
HY-155657-01	BT424