AG004I8Q

87779-78-0 | 3-Bromo-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one

AG004I8Q

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	87779-78-0
Catalog Number	AG004I8Q(AGN-PC-0N7HE0)
Chemical Name	3-Bromo-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
IUPAC Name	3-bromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
InChI	InChI=1S/C11H11BrO/c12-9-6-5-8-3-1-2-4-11(13)10(8)7-9/h5-7H,1-4H2
InChI Key	BBLCBJCONMZHBE-UHFFFAOYSA-N
MDL Number	MFCD11036254
Molecular Formula	C11H11BrO
Molecular Weight	239.1084
SMILES	BrC1=CC=C2CCCCC(=O)C2=C1
Synonyms	87779-78-0, 3-Bromo-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one, 3-bromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one, 5H-Benzocyclohepten-5-one, 3-bromo-6,7,8,9-tetrahydro-, 5H-Benzocyclohepten-5-one,3-bromo-6,7,8,9-tetrahydro-, SCHEMBL3006544, CTK8B9863, DTXSID30442494, BBLCBJCONMZHBE-UHFFFAOYSA-N, KS-00000P9U, 3967AC, ANW-63336, MFCD11036254, ZINC19726983, AKOS012023520, WT81923, AJ-74484, AK-84594, BC682272, DS-17454, TC-152081, FT-0765214, ST24041936, 3-bromo-6,7,8,9-tetrahydro-benzocyclohepten-5-one, 3-bromo-6,7,8,9-tetrahydro-5h-benzocyclohepten-5-one, Z2216711758, C11H11BrO, CID10610018, 9-bromobicyclo[5.4.0]undeca-8,10,12-trien-6-one,

Complexity	202
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	237.999g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	239.112g/mol
Monoisotopic Mass	237.999g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number