AG00IJPA

959756-18-4 | 5-Bromo-3,3-Dimethyl-Isoindolin-1-One

AG00IJPA

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	959756-18-4
Catalog Number	AG00IJPA(AGN-PC-0WCL4E)
Chemical Name	5-Bromo-3,3-Dimethyl-Isoindolin-1-One
IUPAC Name	5-bromo-3,3-dimethyl-2H-isoindol-1-one
InChI	InChI=1S/C10H10BrNO/c1-10(2)8-5-6(11)3-4-7(8)9(13)12-10/h3-5H,1-2H3,(H,12,13)
InChI Key	UQWABTUVMQZARA-UHFFFAOYSA-N
MDL Number	MFCD27937924
Molecular Formula	C10H10BrNO
Molecular Weight	240.0965
SMILES	O=C1NC(C)(C)C2=C1C=CC(Br)=C2
Synonyms	959756-18-4, 5-Bromo-3,3-dimethyl-isoindolin-1-one, 5-Bromo-3,3-dimethyl-2,3-dihydro-1H-isoindol-1-one, 1H-Isoindol-1-one, 5-bromo-2,3-dihydro-3,3-dimethyl-, SCHEMBL1476086, UQWABTUVMQZARA-UHFFFAOYSA-N, MFCD27937924, ZINC116289860, SB11379, KS-000004D2, AS-52012, 5-bromo-3,3-dimethyl-2H-isoindol-1-one, CS-0050604, 5-Bromo-3,3-dimethyl-2,3-dihydroisoindol-1-one, 5-Bromo-2,3-dihydro-3,3-dimethyl-1H-isoindol-1-one,

Complexity	239
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	238.995g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	240.1g/mol
Monoisotopic Mass	238.995g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

Lot Number