AG00DFR4

54109-03-4 | 5-Chloro-1-(3H)-Isobenzofuranone

AG00DFR4

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	54109-03-4
Catalog Number	AG00DFR4(AGN-PC-0JOG9F)
Chemical Name	5-Chloro-1-(3H)-Isobenzofuranone
IUPAC Name	5-chloro-3H-2-benzofuran-1-one
InChI	InChI=1S/C8H5ClO2/c9-6-1-2-7-5(3-6)4-11-8(7)10/h1-3H,4H2
InChI Key	UBRQBEBBOSKYLQ-UHFFFAOYSA-N
MDL Number	MFCD09842447
Molecular Formula	C8H5ClO2
Molecular Weight	168.5771
NSC Number	49581
SMILES	O=C1OCC2=C1C=CC(Cl)=C2
Synonyms	54109-03-4, 5-CHLOROISOBENZOFURAN-1(3H)-ONE, 5-chlorophthalide, 5-chloro-1(3H)-isobenzofuranone, 5-chloro-1-(3h)-isobenzofuranone, 1(3H)-ISOBENZOFURANONE, 5-CHLORO-, 5-chloro-2-benzofuran-1(3h)-one, 5-chloro-1,3-dihydro-2-benzofuran-1-one, NSC49581, AC1L67ZW, AC1Q3OQ7, SCHEMBL855289, CTK4J9632, DTXSID10287188, 5-chloro-3H-isobenzofuran-1-one, UBRQBEBBOSKYLQ-UHFFFAOYSA-N, 5-chloro-3H-2-benzofuran-1-one, 1(3H)-Isobenzofuranone,5-chloro-, ACT09470, KS-00000SL8, ZINC1681452, NSC-49581, 5-chloro-1-(3h)-isobenzo[b]furanone, AKOS006310138, CC-2326, AK161984, AS-35576, AB0073416, DB-071792, TC-066237, FT-0656836, X-2855, I14-5131, Z2327226262, 5-chloro phthalide, 5-Chloro-1- -Isobenzofuranone, AR-1G7720, CID241737, ACN-041126, CS-O-10387, 28033-47-8, 622-29-7,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.998g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	168.576g/mol
Monoisotopic Mass	167.998g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number