AG006WR9

24239-67-6 | 4-Benzyloxy-2-nitrotoluene

AG006WR9

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CAS Number	24239-67-6
Catalog Number	AG006WR9(AGN-PC-0KLBTQ)
Chemical Name	4-Benzyloxy-2-nitrotoluene
IUPAC Name	1-methyl-2-nitro-4-phenylmethoxybenzene
InChI	InChI=1S/C14H13NO3/c1-11-7-8-13(9-14(11)15(16)17)18-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3
InChI Key	DGMVXGHRFDVQHC-UHFFFAOYSA-N
MDL Number	MFCD00100651
Molecular Formula	C14H13NO3
Molecular Weight	243.2579
SMILES	CC1=CC=C(OCC2=CC=CC=C2)C=C1[N+]([O-])=O
Synonyms	4-Benzyloxy-2-nitrotoluene, 24239-67-6, 4-(benzyloxy)-1-methyl-2-nitrobenzene, 1-methyl-2-nitro-4-phenylmethoxybenzene, AC1MCVH7, 4-Benzyloxy-2-nitro toluene, benzyl 3-Nitro-p-tolyl Ether, 4-(Benzyloxy)-2-nitrotoluene, SCHEMBL1240906, CTK0I7535, DTXSID70384263, DGMVXGHRFDVQHC-UHFFFAOYSA-N, ZINC132962, AB03401, CCG-235163, MCULE-2880124653, RP28577, AC-30543, AJ-12155, SC-29841, SY025662, 1-Methyl-2-nitro-4-(phenylmethoxy)benzene, 1-((4-Methyl-3-nitrophenoxy)methyl)benzene, FT-0662975, Z2766, MFCD00100651 (95%), Benzene, 1-methyl-2-nitro-4-(phenylmethoxy)-, W-2504, SR-01000003374, J-514499, SR-01000003374-1, C14H13NO3, ZINC00132962, CID2801507, 4-Benzyloxy-2-nitrotoluene, 97% - 250mg 250mg,

Complexity	271
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.09g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	243.262g/mol
Monoisotopic Mass	243.09g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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