AG003MT0

42298-41-9 | 5-Iodo-2-methoxybenzaldehyde

AG003MT0

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CAS Number	42298-41-9
Catalog Number	AG003MT0(AGN-PC-0JNX5P)
Chemical Name	5-Iodo-2-methoxybenzaldehyde
IUPAC Name	5-iodo-2-methoxybenzaldehyde
InChI	InChI=1S/C8H7IO2/c1-11-8-3-2-7(9)4-6(8)5-10/h2-5H,1H3
InChI Key	PIRKMHAREMCDPZ-UHFFFAOYSA-N
MDL Number	MFCD04128999
Molecular Formula	C8H7IO2
Molecular Weight	262.0445
NSC Number	95686
SMILES	COC1=C(C=O)C=C(I)C=C1
Synonyms	5-iodo-2-methoxybenzaldehyde, 42298-41-9, 2-Methoxy-5-iodobenzaldehyde, 5-Iodo-2-methoxy-benzaldehyde, MFCD04128999, NSC95686, PubChem1445, ACMC-20am2z, AC1Q4PJP, NCIOpen2_005942, AC1L671X, SCHEMBL3733145, Benzaldehyde,5-iodo-2-methoxy-, CTK4I6000, DTXSID30294273, PIRKMHAREMCDPZ-UHFFFAOYSA-N, ZINC1621361, 5-Iodo-2-methoxybenzaldehyde, 97%, 5839AB, NSC-95686, STK399819, AKOS000313259, AB20799, MCULE-4567365128, RP29333, VZ30396, AJ-28343, AS-38025, CJ-26140, SC-65422, AB0076664, AB1008710, DB-050893, TC-070445, 4CH-004496, FT-0639784, ST45067093, 298I419, I01-9226, J-509826, 6-fluoro-2-iodobenzaldehyde, 2-Fluoro-6-iodobenzaldehyde, C8H7IO2, AR-1G8586, CID262240, A6911, 146137-72-6, 4277-89-8,

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	261.949g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	262.046g/mol
Monoisotopic Mass	261.949g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P301+P310-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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