AG00FDZG

7218-52-2 | 4-Hydroxy-but-2-ynoic acid

AG00FDZG

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CAS Number	7218-52-2
Catalog Number	AG00FDZG(AGN-PC-0JQEED)
Chemical Name	4-Hydroxy-but-2-ynoic acid
IUPAC Name	4-hydroxybut-2-ynoic acid
InChI	InChI=1S/C4H4O3/c5-3-1-2-4(6)7/h5H,3H2,(H,6,7)
InChI Key	QVYMWMSAXULCMW-UHFFFAOYSA-N
MDL Number	MFCD06658457
Molecular Formula	C4H4O3
Molecular Weight	100.0728
NSC Number	620042
SMILES	O=C(O)C#CCO
Synonyms	4-hydroxybut-2-ynoic acid, 7218-52-2, 4-HYDROXY-BUT-2-YNOIC ACID, 4-hydroxy-2-butynoic acid, Oxymethylpropiolsaure, NSC620042, AC1L7ECH, 4-oxidanylbut-2-ynoic acid, 2-Butynoic acid, 4-hydroxy-, SCHEMBL6585974, CHEMBL1994370, CTK5D5674, DTXSID00326873, ZINC1615932, 1204AC, MFCD06658457, AKOS006228128, NSC-620042, AJ-28298, AS-30752, DA-41575, NCI60_005920, AB0071079, ST2405835, 4CH-017594, BB 0256961, FT-0745271, Z-5231, 218H522, A837444, I14-13460, C4H4O3, CID359297,

Complexity	124
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	100.016g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	100.073g/mol
Monoisotopic Mass	100.016g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	57.5A^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

Lot Number