AG00EL2I

Name: 5-(tert-Butyl)furan-2-carboxylic acid
Brand: Angene Chemical
SKU: AG00EL2I

56311-39-8 | 5-(tert-Butyl)furan-2-carboxylic acid

AG00EL2I

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CAS Number	56311-39-8
Catalog Number	AG00EL2I(AGN-PC-0LCKG7)
Chemical Name	5-(tert-Butyl)furan-2-carboxylic acid
IUPAC Name	5-tert-butylfuran-2-carboxylic acid
InChI	InChI=1S/C9H12O3/c1-9(2,3)7-5-4-6(12-7)8(10)11/h4-5H,1-3H3,(H,10,11)
InChI Key	JWZMCIVGRRFEEX-UHFFFAOYSA-N
MDL Number	MFCD00094279
Molecular Formula	C9H12O3
Molecular Weight	168.1898
SMILES	O=C(C1=CC=C(C(C)(C)C)O1)O
Synonyms	5-tert-butylfuran-2-carboxylic Acid, 56311-39-8, 5-(tert-butyl)furan-2-carboxylic acid, 5-TERT-BUTYL-2-FUROIC ACID, 2-Furancarboxylic acid, 5-(1,1-dimethylethyl)-, AC1NCXRI, AC1Q1M8P, 2-tertbutyl 5-furanoic acid, SCHEMBL3225051, CTK1F4912, DTXSID80403873, 5-t-butylfuran-2-carboxylic acid, JWZMCIVGRRFEEX-UHFFFAOYSA-N, ZINC400141, ALBB-010354, ZX-AN009199, ZX-CM000428, 8237AB, FCH839390, MFCD00094279, RW2725, SBB005661, STL426842, AKOS003392419, MCULE-2823958014, AJ-21777, AM807204, DA-19109, ST078119, AB0050534, AX8248230, FT-0683236, W-6464, I04-3866, C9H12O3, 5-(tert-Butyl)furan-2-carboxylicacid, ACN-029006, CID4519050,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.079g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	168.192g/mol
Monoisotopic Mass	168.079g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	50.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited