AG01E4I2

443922-06-3 | 4,4’,4’’-(1,3,5-Triazine-2,4,6-triyl)tris[benzaldehyde]

AG01E4I2

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CAS Number	443922-06-3
Catalog Number	AG01E4I2
Chemical Name	4,4’,4’’-(1,3,5-Triazine-2,4,6-triyl)tris[benzaldehyde]
IUPAC Name	4-[4,6-bis(4-formylphenyl)-1,3,5-triazin-2-yl]benzaldehyde
InChI	InChI=1S/C24H15N3O3/c28-13-16-1-7-19(8-2-16)22-25-23(20-9-3-17(14-29)4-10-20)27-24(26-22)21-11-5-18(15-30)6-12-21/h1-15H
InChI Key	RXFWPOMAJBVGRU-UHFFFAOYSA-N
MDL Number	MFCD31631359
Molecular Formula	C24H15N3O3
Molecular Weight	393.3942
SMILES	N1=C(N=C(N=C1C1=CC=C(C=O)C=C1)C1=CC=C(C=O)C=C1)C1=CC=C(C=O)C=C1
Synonyms	4,4',4''-(1,3,5-triazine-2,4,6-triyl)tribenzaldehyde, 443922-06-3, AKOS032945349, ACN-049208, 4,4',4''-(1,3,5-Triazine-2,4,6-triyl)trisbenzaldehyde, Benzaldehyde,4,4',4''-(1,3,5-triazine-2,4,6-triyl)tris-,

Complexity	483
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	393.111g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	393.402g/mol
Monoisotopic Mass	393.111g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	89.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	\N

Certificate of Analysis

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