AG00DHXG

52867-35-3 | 1-Methyl-1H-pyrazol-3(2H)-one

AG00DHXG

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	52867-35-3
Catalog Number	AG00DHXG(AGN-PC-008TJI)
Chemical Name	1-Methyl-1H-pyrazol-3(2H)-one
IUPAC Name	2-methyl-1H-pyrazol-5-one
InChI	InChI=1S/C4H6N2O/c1-6-3-2-4(7)5-6/h2-3H,1H3,(H,5,7)
InChI Key	WIISOYLZJJYTHT-UHFFFAOYSA-N
MDL Number	MFCD26743528
Molecular Formula	C4H6N2O
Molecular Weight	98.1032
SMILES	CN1NC(C=C1)=O
Synonyms	1-Methyl-1H-pyrazol-3(2H)-one, 52867-35-3, 1-Methyl-1H-pyrazol-3-ol, 3H-Pyrazol-3-one, 1,2-dihydro-1-methyl-, 3-Hydroxy-1-methyl-1H-pyrazole, AK-67583, N-methylpyrazolone, 1-methylpyrazolone, hydroxy-1-methyl-pyrazole, DTXSID90465321, WIISOYLZJJYTHT-UHFFFAOYSA-N, 1-Methyl-1H-Pyrazole-3(2)-one, KS-00000OB6, BBL102212, MFCD26743528, STL556011, ZINC34545540, AKOS016000964, AKOS017343765, ACN-036831, CS-W004808, EBD2214029, MP-0329, 3-Hydroxy-1-methyl-1H-pyrazole, 96%, 1-Methyl-1,2-dihydro-3H-pyrazol-3-one, AJ-89217, SC-98976, AX8250567, 4CH-009995, ST24027118, Z-4979, Z2218555171, 1-methyl-2H-pyrazol-3-one, CID11423563, 1-methyl-2,3-dihydro-1H-pyrazol-3-one,

Complexity	119
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	98.048g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	98.105g/mol
Monoisotopic Mass	98.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number