AG00093U

113602-62-3 | Methyl 3-hydroxy-1-methyl-1H-pyrrole-2-carboxylate

AG00093U

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CAS Number	113602-62-3
Catalog Number	AG00093U(AGN-PC-0AATSV)
Chemical Name	Methyl 3-hydroxy-1-methyl-1H-pyrrole-2-carboxylate
IUPAC Name	methyl 3-hydroxy-1-methylpyrrole-2-carboxylate
InChI	InChI=1S/C7H9NO3/c1-8-4-3-5(9)6(8)7(10)11-2/h3-4,9H,1-2H3
InChI Key	HJHSYAMEFMNNBD-UHFFFAOYSA-N
MDL Number	MFCD12924083
Molecular Formula	C7H9NO3
Molecular Weight	155.1513
SMILES	O=C(C1=C(O)C=CN1C)OC
Synonyms	Methyl 3-hydroxy-1-methyl-1H-pyrrole-2-carboxylate, 113602-62-3, methyl 3-hydroxy-1-methylpyrrole-2-carboxylate, 1H-Pyrrole-2-carboxylic acid, 3-hydroxy-1-methyl-, methyl ester, ACMC-20mimd, SCHEMBL9826739, CTK0G1193, KS-00000SLM, DTXSID40715989, HJHSYAMEFMNNBD-UHFFFAOYSA-N, MFCD12924083, AKOS023838773, ZINC170637629, DS-7450, AK162103, ST24047833, W-4464, Z2009851127, 1-Methyl-3-hydroxy-1H-pyrrole-2-carboxylic acid methyl ester, CID10986477, (2Z)-2-(hydroxy-methoxy-methylidene)-1-methyl-pyrrol-3-one,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	155.058g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	155.153g/mol
Monoisotopic Mass	155.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	51.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

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