AG005GAG

81-96-9 | 7H-Benz[de]anthracen-7-one,3-bromo-

AG005GAG

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CAS Number	81-96-9
Catalog Number	AG005GAG(AGN-PC-0JK7PC)
Chemical Name	7H-Benz[de]anthracen-7-one,3-bromo-
EC Number	201-390-7
IUPAC Name	3-bromobenzo[b]phenalen-7-one
InChI	InChI=1S/C17H9BrO/c18-15-9-8-11-10-4-1-2-5-12(10)17(19)14-7-3-6-13(15)16(11)14/h1-9H
InChI Key	WVECFEIAZAKUNF-UHFFFAOYSA-N
MDL Number	MFCD00021094
Molecular Formula	C17H9BrO
Molecular Weight	309.1568
NSC Number	13976
SMILES	O=C1C2=C(C=CC=C2)C3=C4C(C=CC=C14)=C(Br)C=C3
UNII	3DH9916FNO
Synonyms	3-bromobenz(de)anthracen-7-one, 3-bromobenzanthrone, 3-Bromobenzanthrone, 81-96-9, 3-Brombenzanthrone, Benzanthrone, 3-bromo-, 7-Bromomesobenzanthrone, 3-Bromo-7H-benz[de]anthracene-7-one, 3-Bromo-7H-benzo[de]anthracen-7-one, 7H-Benz[de]anthracen-7-one, 3-bromo-, 3-Bromobenz(d,e)anthrone, NSC 13976, 3-Bromo-7H-benz(de)anthracen-7-one, 3-bromobenzo[b]phenalen-7-one, EINECS 201-390-7, 7H-Benz[de]anthracen-7-one,3-bromo-, BRN 1975512, UNII-3DH9916FNO, 3DH9916FNO, 3-Bromobenz(de)anthracen-7-one, 3-Bromobenz[de]anthracen-7-one, 7H-BENZ(de)ANTHRACEN-7-ONE, 3-BROMO-, WVECFEIAZAKUNF-UHFFFAOYSA-N, MFCD00021094, 3-Bromobenz[d,e]anthrone, 3-Bromo-7H-benz[de]anthracen-7-one, 3-Bromo-7H-Benz(De)Anthracene-7-One, 14-bromotetracyclo[7.7.1.0^{2,7}.0^{13,17}]heptadeca-1(16),2(7),3,5,9(17),10,12,14-octaen-8-one, 3-Bromo-benzanthrone, 3-Bromo Benzanthrone, 3-Bromobenz[de]anthrone, AC1L1N3M, 4-07-00-01820 (Beilstein Handbook Reference), 3-bromo-7-benzo[b]phenalenone, SCHEMBL1983882, DTXSID9058860, CTK5E9261, KS-00000JPH, 3-bromobenz(d,e)anthracen-7-one, 3-bromanylbenzo[b]phenalen-7-one, AC1Q2520, NSC13976, ZINC3875547, BBL010353, NSC-13976, STK801556, AKOS001073212, DS-3440, MCULE-5357347018, VZ35010, WLN: L C6666 1A Q IVJ OE, 7H-Benz[de]anthracene-7-one, 3-bromo-, AC-11850, AK543296, AN-42235, LS-27946, 3-BROMOBENZANTHRONE TECHNICAL GRADE, DB-075800, EU-0000135, FT-0615196, ST50409234, 021B094, A840227, AE-641/00609011, SR-01000389293, SR-01000389293-1, W-104192, Z56886929, F0266-1973, 14-bromotetracyclo[7.7.1.0(2),.0(1)(3),(1)]heptadeca-1(17),2,4,6,9,11,13,15-octaen-8-one, 14-bromotetracyclo[7.7.1.0^{2,7}.0^{13,17}]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-8-one, C17H9BrO, 3-brombenz[de]anthracen-7-on, C17-H9-Br-O, CID6696,

Complexity	380
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	307.984g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	309.162g/mol
Monoisotopic Mass	307.984g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H412
Packing Group
Precautionary statements	P273
UN Code

Certificate of Analysis

Lot Number