AG007VNF

172900-75-3 | Benzaldehyde, 4-Methoxy-3-(3-Methoxypropoxy)-

AG007VNF

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CAS Number	172900-75-3
Catalog Number	AG007VNF(AGN-PC-004LPS)
Chemical Name	Benzaldehyde, 4-Methoxy-3-(3-Methoxypropoxy)-
EC Number	605-653-0
IUPAC Name	4-methoxy-3-(3-methoxypropoxy)benzaldehyde
InChI	InChI=1S/C12H16O4/c1-14-6-3-7-16-12-8-10(9-13)4-5-11(12)15-2/h4-5,8-9H,3,6-7H2,1-2H3
InChI Key	RBSXHAWCVPPVNP-UHFFFAOYSA-N
MDL Number	MFCD11113215
Molecular Formula	C12H16O4
Molecular Weight	224.2530
SMILES	COCCCOC1=C(OC)C=CC(C=O)=C1
Synonyms	4-methoxy-3-(3-methoxypropoxy)benzaldehyde, 172900-75-3, 3-(3-methoxypropoxy)-4-methoxybenzaldehyde, Benzaldehyde, 4-methoxy-3-(3-methoxypropoxy)-, 4-Methoxy-3-(3-methoxy-propoxy)-benzaldehyde, AC1Q4FUO, KSC174K4D, SCHEMBL218012, CTK0H4541, KS-00000ZIU, DTXSID40459098, RBSXHAWCVPPVNP-UHFFFAOYSA-N, 8917AA, ANW-54626, SBB064914, ZINC34409183, AKOS009825523, NE50845, AJ-88360, CJ-18349, DB-064883, RT-003389, 4-methoxy-3-(3-methoxypropoxy)-benzaldehyde, FT-0652690, ST24043844, EN300-60504, A1-02628, I01-6286, 4-Methoxy-3-(3-methoxypropoxy)-benzaldehyde, AldrichCPR, C12H16O4, CID11218358, A3820,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.105g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	224.256g/mol
Monoisotopic Mass	224.105g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	44.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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