AG00EIMS

61921-39-9 | 4-Bromobenzo[a]anthracene

AG00EIMS

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CAS Number	61921-39-9
Catalog Number	AG00EIMS(AGN-PC-0CWDW2)
Chemical Name	4-Bromobenzo[a]anthracene
IUPAC Name	4-bromobenzo[a]anthracene
InChI	InChI=1S/C18H11Br/c19-18-7-3-6-15-16(18)9-8-14-10-12-4-1-2-5-13(12)11-17(14)15/h1-11H
InChI Key	ILVKEMDEUCXCAB-UHFFFAOYSA-N
MDL Number	MFCD25371993
Molecular Formula	C18H11Br
Molecular Weight	307.1839
SMILES	BrC1=CC=CC2=C(C=C3C(C=CC=C3)=C4)C4=CC=C21
Synonyms	4-bromotetraphene, 61921-39-9, 4-bromobenzo[a]anthracene, 4-bromobenz[a]anthracene, Benz[a]anthracene, 4-bromo-, Benz(a)anthracene, 4-bromo-, AC1L4AQN, SCHEMBL1517516, CTK2D0219, DTXSID30210953, ILVKEMDEUCXCAB-UHFFFAOYSA-N, KS-00000SB3, MFCD25371993, ZINC81946234, DS-9513, AK151479, AJ-124029, AX8272552, B5450, FT-0707268, X5616, C18H11Br, CID182324, ACN-029743, CID 182324,

Complexity	326
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	306.004g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	307.19g/mol
Monoisotopic Mass	306.004g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.4

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