AG00643K

Name: 3-Isobutoxybenzaldehyde
Brand: Angene Chemical
SKU: AG00643K

67698-69-5 | 3-Isobutoxybenzaldehyde

AG00643K

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CAS Number	67698-69-5
Catalog Number	AG00643K(AGN-PC-0KKN6F)
Chemical Name	3-Isobutoxybenzaldehyde
IUPAC Name	3-(2-methylpropoxy)benzaldehyde
InChI	InChI=1S/C11H14O2/c1-9(2)8-13-11-5-3-4-10(6-11)7-12/h3-7,9H,8H2,1-2H3
InChI Key	KYAHWUCUKPTNKW-UHFFFAOYSA-N
MDL Number	MFCD01993681
Molecular Formula	C11H14O2
Molecular Weight	178.2277
SMILES	O=CC1=CC=CC(=C1)OCC(C)C
Synonyms	3-isobutoxybenzaldehyde, 67698-69-5, 3-(2-methylpropoxy)benzaldehyde, 3-isobutoxy-benzaldehyde, AC1Q1PSC, AC1MC09Y, SCHEMBL272554, CTK5C6538, DTXSID20374775, KYAHWUCUKPTNKW-UHFFFAOYSA-N, 3-Isobutoxybenzaldehyde, AldrichCPR, ALBB-001152, ZINC2576200, 7959AE, BBL013685, MFCD01993681, SBB017365, STK346826, AKOS000186621, MCULE-1799344059, DA-04403, ST078339, TR-051468, A9062, BB 0242997, FT-0705103, EN300-92249, W-8914, I01-7121, C11H14O2, ZINC02576200, CID2759381,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.099g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	178.231g/mol
Monoisotopic Mass	178.099g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

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