AG0010PM

13246-46-3 | Benzaldehyde, 2,4-bis(phenylmethoxy)-

AG0010PM

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CAS Number	13246-46-3
Catalog Number	AG0010PM(AGN-PC-0K9AM1)
Chemical Name	Benzaldehyde, 2,4-bis(phenylmethoxy)-
IUPAC Name	2,4-bis(phenylmethoxy)benzaldehyde
InChI	InChI=1S/C21H18O3/c22-14-19-11-12-20(23-15-17-7-3-1-4-8-17)13-21(19)24-16-18-9-5-2-6-10-18/h1-14H,15-16H2
InChI Key	DMYYTMVFUMDOGC-UHFFFAOYSA-N
MDL Number	MFCD00022024
Molecular Formula	C21H18O3
Molecular Weight	318.3658
SMILES	O=CC1=CC=C(OCC2=CC=CC=C2)C=C1OCC3=CC=CC=C3
Synonyms	2,4-bis(benzyloxy)benzaldehyde, 13246-46-3, 2,4-dibenzyloxy benzaldehyde, Benzaldehyde, 2,4-bis(phenylmethoxy)-, 2,4-dibenzyloxybenzaldehyde, 2,4-bis(phenylmethoxy)benzaldehyde, AC1LXW6Y, AC1Q6PRP, 2,4-bisbenzyloxybenzaldehyde, SCHEMBL865350, CTK0F5064, DTXSID50365212, DMYYTMVFUMDOGC-UHFFFAOYSA-N, ZINC2164199, 5331AJ, ICCB5_000066, MFCD00022024, AKOS000290591, MCULE-1645461970, NE17759, DA-12286, SY025203, AB1004783, FT-0748772, EN300-29381, MFCD00022024 (95%), AE-848/01265042, A1-00226, null, C21H18O3, ZINC02164199, ACN-001673, CID1809080,

Complexity	358
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	318.126g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	318.372g/mol
Monoisotopic Mass	318.126g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P261-P280-P305+P351+P338-P304+P340-P405
UN Code

Certificate of Analysis

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