AG00AP49

161489-05-0 | 4-Iodo-6-methoxypyrimidine

AG00AP49

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CAS Number	161489-05-0
Catalog Number	AG00AP49(AGN-PC-0LWSBD)
Chemical Name	4-Iodo-6-methoxypyrimidine
IUPAC Name	4-iodo-6-methoxypyrimidine
InChI	InChI=1S/C5H5IN2O/c1-9-5-2-4(6)7-3-8-5/h2-3H,1H3
InChI Key	QDBUDQCGLQIPKI-UHFFFAOYSA-N
MDL Number	MFCD07787396
Molecular Formula	C5H5IN2O
Molecular Weight	236.0105
SMILES	IC1=NC=NC(=C1)OC
Synonyms	4-Iodo-6-methoxypyrimidine, 161489-05-0, AK-37493, AC1OFHDO, ACMC-209dmp, SCHEMBL1679584, CTK6J8369, KS-00000JVY, DTXSID00427793, QDBUDQCGLQIPKI-UHFFFAOYSA-N, ZINC4198800, ZX-AT001677, ANW-21935, MFCD07787396, AKOS015852326, CM10843, CS-W020678, FCH1324151, I2358G1, OR15524, PS-3827, RP08446, RTR-038818, AJ-48275, BR-37493, CJ-11378, HC210504, SY031628, AB0022601, AX8025994, DB-064399, ST2418421, TR-038818, 4CH-003149, AM20080440, FT-0685318, W3502, MFCD07787396 (95%), B-7379, C5H5IN2O, ZINC04198800, CID7127182,

Complexity	91
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	235.945g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	236.012g/mol
Monoisotopic Mass	235.945g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number