Griseofulvin

CAT: 0024-sc-202171BSize: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-202171BSize:100 mg

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

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CAS Number

126-07-8

Chemical Information

Griseofulvin

Griseofulvin can cause cancer according to The World Health Organization's International Agency for Research on Cancer (IARC).

CAS Number	126-07-8
PubChem CID	441140
IUPAC Name	(2S,5'R)-7-chloro-3',4,6-trimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione
Molecular Formula	C17H17ClO6
Molecular Weight	352.8
XLogP	2.2
Topological Polar Surface Area	71.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Heavy Atom Count	24
Formal Charge	0
Complexity	575

SMILES

C[C@@H]1CC(=O)C=C([C@]12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)OC

InChI

InChI=1S/C17H17ClO6/c1-8-5-9(19)6-12(23-4)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)24-17/h6-8H,5H2,1-4H3/t8-,17+/m1/s1

InChIKey

DDUHZTYCFQRHIY-RBHXEPJQSA-N

Chemical Structure

2D Structure

CAS: 126-07-8

CID: 441140

Formula: C17H17ClO6

MW: 352.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	352.8
XLogP3	2.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	352.0713660
Monoisotopic Mass	352.0713660
Topological Polar Surface Area	71.1 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	575
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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
T1382-01	Griseofulvin
G7910-01	(+) -Griseofulvin