AG002JFM

2080-75-3 | 5-Methoxy-2-benzimidazolinone

AG002JFM

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CAS Number	2080-75-3
Catalog Number	AG002JFM(AGN-PC-0JTF3A)
Chemical Name	5-Methoxy-2-benzimidazolinone
IUPAC Name	5-methoxy-1,3-dihydrobenzimidazol-2-one
InChI	InChI=1S/C8H8N2O2/c1-12-5-2-3-6-7(4-5)10-8(11)9-6/h2-4H,1H3,(H2,9,10,11)
InChI Key	AUPLVAKFTYFHTA-UHFFFAOYSA-N
MDL Number	MFCD01462048
Molecular Formula	C8H8N2O2
Molecular Weight	164.1613
SMILES	O=C1NC2=CC=C(OC)C=C2N1
Synonyms	2080-75-3, 5-Methoxy-1H-benzo[d]imidazol-2(3H)-one, 5-METHOXY-2-BENZIMIDAZOLINONE, 2-Hydroxy-5-methoxybenzimidazole, 5-methoxy-1,3-dihydrobenzimidazol-2-one, 5-METHOXY-2-HYDROXYBENZIMIDAZOLE, AUPLVAKFTYFHTA-UHFFFAOYSA-N, 2H-Benzimidazol-2-one, 1,3-dihydro-5-methoxy-, MFCD00051946, 208-75-3, 1,3-DIHYDRO-5-METHOXY-2H-BENZIMIDAZOLE-2-ONE, 5-methoxy-3-hydrobenzimidazol-2-one, 2-Benzimidazolinone, 5-methoxy-, AC1LBYBF, ACMC-20am2l, Esomeprazole Impurity 4, 5-methoxy-1,3-dihydro-benzoimidazol-2-one, 5-methoxybenzimidazol-2-one, 5-Methoxybenzimidazolin-2-one, SCHEMBL2107333, CHEMBL3218377, CTK3J5758, CTK8H5550, DTXSID10343637, ZINC2510147, SBB059283, 2-Hydroxy-5-methoxy-1H-benzimidazole, AKOS005206706, AKOS009157990, 5-METHOXY-BENZIMIDAZOLIN-2-ONE, AB02155, MCULE-3773947724, 5-Methoxy-1H-benzimidazole-2(3H)-one, AJ-36391, AK115625, DB-017684, CS-0043842, FT-0620551, FT-0728594, ST50407313, 1,3-Dihydro-5-methoxy-2H-benzimidazol-2-one, 2H-Benzimidazol-2-one,1,3-dihydro-5-methoxy-, J-013638, W-201827, CID591101, ZINC00156680, ACN-043896, 5-methoxy-1H-benzo[d]imidazol-2(3H)-on,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.059g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	164.164g/mol
Monoisotopic Mass	164.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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

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