AG006QSB

Name: 4-(tert-Butyl)-3-iodobenzoic acid
Brand: Angene Chemical
SKU: AG006QSB

91131-72-5 | 4-(tert-Butyl)-3-iodobenzoic acid

AG006QSB

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CAS Number	91131-72-5
Catalog Number	AG006QSB(AGN-PC-0WAMZD)
Chemical Name	4-(tert-Butyl)-3-iodobenzoic acid
IUPAC Name	4-tert-butyl-3-iodobenzoic acid
InChI	InChI=1S/C11H13IO2/c1-11(2,3)8-5-4-7(10(13)14)6-9(8)12/h4-6H,1-3H3,(H,13,14)
InChI Key	RKQXGGKRIINFTM-UHFFFAOYSA-N
MDL Number	MFCD11110767
Molecular Formula	C11H13IO2
Molecular Weight	304.1242
SMILES	O=C(O)C1=CC=C(C(C)(C)C)C(I)=C1
Synonyms	4-(tert-Butyl)-3-iodobenzoic acid, 91131-72-5, 4-tert-butyl-3-iodobenzoic acid, CTK8C6778, KS-00000RDA, DTXSID30660772, 4-tert-butyl-3-iodanyl-benzoic acid, 5212AC, MFCD11110767, ZINC39951746, AKOS015841137, AK-93343, DS-17821, AJ-100828, DB-078912, ST2401870, TC-067078, 4CH-019473, CS-0060873, FT-0653177, S-1181, A843732, I01-6095, C11H13IO2,

Complexity	220
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	303.996g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	304.127g/mol
Monoisotopic Mass	303.996g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

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