AG00DD93

5378-29-0 | 3-(1,3,4-Oxadiazol-2-yl)phenol

AG00DD93

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CAS Number	5378-29-0
Catalog Number	AG00DD93(AGN-PC-0L8SWZ)
Chemical Name	3-(1,3,4-Oxadiazol-2-yl)phenol
IUPAC Name	3-(1,3,4-oxadiazol-2-yl)phenol
InChI	InChI=1S/C8H6N2O2/c11-7-3-1-2-6(4-7)8-10-9-5-12-8/h1-5,11H
InChI Key	CSMNFUDFDBVTHP-UHFFFAOYSA-N
MDL Number	MFCD06643238
Molecular Formula	C8H6N2O2
Molecular Weight	162.1454
SMILES	OC1=CC=CC(C2=NN=CO2)=C1
Synonyms	3-(1,3,4-oxadiazol-2-yl)phenol, 5378-29-0, 3-[1,3,4]Oxadiazol-2-yl-phenol, AC1N7DFL, AC1Q78IZ, SCHEMBL859977, CTK4J8782, DTXSID70401702, CSMNFUDFDBVTHP-UHFFFAOYSA-N, ZINC6471675, MFCD06643238, ODZ100104, SBB077112, STK950751, 3-(1,3,4-oxadiazol-2-yl)-phenol, AKOS001219775, MCULE-3619052089, AJ-56213, AM807170, Phenol, 3-(1,3,4-oxadiazol-2-yl)-, AB1008940, BB 0238369, ST50107708, EN300-35475, 3-(1,3,4-Oxadiazol-2-yl)phenol, AldrichCPR, Y-2324, AT-057/42874598, Z57615381, null, 3- phenol, ZINC06471675, CID4300762,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.043g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	162.148g/mol
Monoisotopic Mass	162.043g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	59.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P301+P312
UN Code

Certificate of Analysis

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