AG003P60

50494-42-3 | Cyclopent-3-enecarboxamide

AG003P60

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CAS Number	50494-42-3
Catalog Number	AG003P60(AGN-PC-0570A6)
Chemical Name	Cyclopent-3-enecarboxamide
IUPAC Name	cyclopent-3-ene-1-carboxamide
InChI	InChI=1S/C6H9NO/c7-6(8)5-3-1-2-4-5/h1-2,5H,3-4H2,(H2,7,8)
InChI Key	XVPVECZALBQBJX-UHFFFAOYSA-N
MDL Number	MFCD09475822
Molecular Formula	C6H9NO
Molecular Weight	111.1418
SMILES	O=C(C1CC=CC1)N
Synonyms	Cyclopent-3-enecarboxamide, 50494-42-3, Cyclopent-3-ene-1-carboxamide, ACMC-1AKL8, 3-Cyclopentene-1-carboxamide, Cyclopentene-4alpha-carboxamide, SCHEMBL4067739, CTK1G9061, DTXSID90649982, 6951AB, ANW-31018, MFCD09475822, ZINC15021095, AKOS006345046, DS-3656, RP19019, AJ-66844, AK107173, CJ-14947, TR-018038, A-5742, J-520174, I14-25165, C6H9NO,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	111.068g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	111.144g/mol
Monoisotopic Mass	111.068g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	43.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

Lot Number