AG003LGS

52364-72-4 | 4-Heptyloxy-4-cyanobiphenyl

AG003LGS

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CAS Number	52364-72-4
Catalog Number	AG003LGS(AGN-PC-0JLE6H)
Chemical Name	4-Heptyloxy-4-cyanobiphenyl
EC Number	257-876-4
IUPAC Name	4-(4-heptoxyphenyl)benzonitrile
InChI	InChI=1S/C20H23NO/c1-2-3-4-5-6-15-22-20-13-11-19(12-14-20)18-9-7-17(16-21)8-10-18/h7-14H,2-6,15H2,1H3
InChI Key	JPBFKTCKZLMJED-UHFFFAOYSA-N
MDL Number	MFCD00134146
Molecular Formula	C20H23NO
Molecular Weight	293.4027
SMILES	CCCCCCCOc1ccc(cc1)c2ccc(cc2)C#N
Synonyms	52364-72-4, 4'-Heptyloxy-4-cyanobiphenyl, 4'-(heptyloxy)biphenyl-4-carbonitrile, 4'-(Heptyloxy)-[1,1'-biphenyl]-4-carbonitrile, 4-Cyano-4'-heptyloxybiphenyl, 7COB, [1,1'-Biphenyl]-4-carbonitrile, 4'-(heptyloxy)-, 4-Heptyloxycyanodiphenyl, 4-Cyano-4'-heptoxybiphenyl, 4-(4-heptoxyphenyl)benzonitrile, Ro CB 5324, 4-(4-Heptyloxyphenyl)benzonitrile, 7OCB, EINECS 257-876-4, 4'-(Heptyloxy)-4-biphenylcarbonitrile, 4-heptyloxy-4-cyanobiphenyl, BRN 2217183, 4-cyano-4'-n-heptyloxybiphenyl, D 107, 4'-(Heptyloxy)(1,1'-biphenyl)-4-carbonitrile, 4'-(Heptyloxy)-(1,1'-biphenyl)-4-carbonitrile, (1,1'-Biphenyl)-4-carbonitrile, 4'-(heptyloxy)-, 4-(4-heptyloxyphenyl)benzenecarbonitrile, PubChem2526, ACMC-209kyy, AC1Q4RRK, AC1L2W9F, 4-heptyloxy-4'-cyanobiphenyl, 4-Cyano-4\'-heptyloxybiphenyl, SCHEMBL2463814, DTXSID4068747, CTK4J5802, JPBFKTCKZLMJED-UHFFFAOYSA-N, ALBB-024914, KS-00000G0T, ZINC2023187, ZX-AN023428, 4'-Heptyloxy-4-biphenylcarbonitrile, ANW-31448, CH-084, MFCD00134146, SBB059228, STK664285, 4-(4-heptoxyphenyl)benzenecarbonitrile, AKOS001483290, DS-6478, FR-2520, MCULE-1813520410, RL03929, VZ27379, ACM52364724, AK129905, AN-41001, CC-19382, LS-44205, AX8001243, DV1764100, ST4022416, TR-018584, C1606, FT-0640065, R2252, [1,1'-Biphenyl]-4-carbonitrile,4'-(heptyloxy)-, 364C724, 4'-(Heptyloxy)[1,1'-biphenyl]-4-carbonitrile #, A829046, C-18417, J-513739, A1029/0048181, 4 inverted exclamation marka-(Heptyloxy)-4-biphenylcarbonitrile, 4'-n-Heptyloxy-4-biphenylcarbonitrile 4-(4'-n-Heptyloxyphenyl)benzonitrile, C20H23NO, 4-n-Heptyloxy-4'-cyanobiphenyl, C20-H23-N-O, 4-Heptyloxy-4'-biphenylcarbonitrile, AR-1F7015, CID104172, 4-Cyano-4'-heptyloxybiphenyl, 98% - 1G 1g, 4'-(Heptyloxy)[1,1'-biphenyl]-4-carbonitrile, 5336-44-7,

Complexity	329
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	293.178g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	293.41g/mol
Monoisotopic Mass	293.178g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	33A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Signal Words	warning
UN Code	\N

Certificate of Analysis

Lot Number