AG003K2I

69240-56-8 | 4-(4-Bromophenoxy)benzaldehyde

AG003K2I

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CAS Number	69240-56-8
Catalog Number	AG003K2I(AGN-PC-0N7Y7X)
Chemical Name	4-(4-Bromophenoxy)benzaldehyde
IUPAC Name	4-(4-bromophenoxy)benzaldehyde
InChI	InChI=1S/C13H9BrO2/c14-11-3-7-13(8-4-11)16-12-5-1-10(9-15)2-6-12/h1-9H
InChI Key	WMDDJOBNAOVSLP-UHFFFAOYSA-N
MDL Number	MFCD08276811
Molecular Formula	C13H9BrO2
Molecular Weight	277.1134
SMILES	O=CC1=CC=C(OC2=CC=C(Br)C=C2)C=C1
Synonyms	4-(4-Bromophenoxy)benzaldehyde, 69240-56-8, 4-(4-Bromo-phenoxy)benzaldehyde, 4-(4-Bromo-phenoxy)-benzaldehyde, MFCD08276811, ACMC-20amwk, SCHEMBL260494, 4-(4-bromophenoxy) benzaldehyde, CTK5C9299, DTXSID80442863, WMDDJOBNAOVSLP-UHFFFAOYSA-N, ZX-RL001416, ZINC11947696, AKOS000260023, 4-(4-Bromophenoxy)benzaldehyde, 97%, AS-8717, OR110490, DB-074149, TC-169355, FT-0749086, Z0784, Q-7042, 429B438, C13H9BrO2, CID10636240,

Complexity	216
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	275.979g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	277.117g/mol
Monoisotopic Mass	275.979g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H317-H318
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 3077

Certificate of Analysis

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