AG0017UX

1380291-34-8 | Cyclobutanepropanoic acid, 3-oxo-

AG0017UX

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CAS Number	1380291-34-8
Catalog Number	AG0017UX(AGN-PC-0WNGXQ)
Chemical Name	Cyclobutanepropanoic acid, 3-oxo-
IUPAC Name	3-(3-oxocyclobutyl)propanoic acid
InChI	InChI=1S/C7H10O3/c8-6-3-5(4-6)1-2-7(9)10/h5H,1-4H2,(H,9,10)
InChI Key	ZJEMXLAAKZUGEP-UHFFFAOYSA-N
MDL Number	MFCD24503127
Molecular Formula	C7H10O3
Molecular Weight	142.1525
SMILES	O=C(O)CCC1CC(C1)=O
Synonyms	3-(3-oxocyclobutyl)propanoic acid, 1380291-34-8, SCHEMBL9106968, ZJEMXLAAKZUGEP-UHFFFAOYSA-N, 3-(3-oxo-cyclobutyl)propanoic acid, MFCD24503127, 3-(3-Oxo-cyclobutyl)-propionic acid, AKOS030525670, ZINC168214009, SB22464, KS-000006E5, AS-53471, SC-93096, CS-0051756, F2147-8319,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	142.063g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	142.154g/mol
Monoisotopic Mass	142.063g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	54.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number