AG000FJ8

Name: 3-Methoxy-4-(3-methylbutoxy)benzaldehyde
Brand: Angene Chemical
SKU: AG000FJ8

114991-69-4 | 3-Methoxy-4-(3-methylbutoxy)benzaldehyde

AG000FJ8

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CAS Number	114991-69-4
Catalog Number	AG000FJ8(AGN-PC-0JUR4E)
Chemical Name	3-Methoxy-4-(3-methylbutoxy)benzaldehyde
IUPAC Name	3-methoxy-4-(3-methylbutoxy)benzaldehyde
InChI	InChI=1S/C13H18O3/c1-10(2)6-7-16-12-5-4-11(9-14)8-13(12)15-3/h4-5,8-10H,6-7H2,1-3H3
InChI Key	QMAVUZPWNRBYAO-UHFFFAOYSA-N
MDL Number	MFCD01459894
Molecular Formula	C13H18O3
Molecular Weight	222.2802
SMILES	COC1=C(OCCC(C)C)C=CC(C=O)=C1
Synonyms	3-methoxy-4-(3-methylbutoxy)benzaldehyde, 114991-69-4, 4-(Isopentyloxy)-3-methoxybenzaldehyde, 3-Methoxy-4-(3-methyl-butoxy)-benzaldehyde, AC1LDRNR, ARONIS23746, Vanillin, 3-methylbutyl ether, AC1Q479G, AC1Q479H, ARONIS023860, SCHEMBL13220903, CTK4A9004, ZINC35877, DTXSID60350114, QMAVUZPWNRBYAO-UHFFFAOYSA-N, ALBB-001146, 9527AC, BBL022990, MFCD01459894, SBB079910, STK502412, AKOS000115360, MCULE-8918590977, RTR-051464, ST005679, 3-Methoxy-4-(3-Methyl-Butoxy)Benzaldehyde, DB-030459, TR-051464, BB 0258823, FT-0767838, R4607, Benzaldehyde, 3-methoxy-4-(3-methylbutoxy)-, EN300-01109, C13H18O3, CID673723, ZINC00035877,

Complexity	203
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.126g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	222.284g/mol
Monoisotopic Mass	222.126g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

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