AG001RXB

160446-35-5 | 1H-Imidazole-4-propanoic acid, 1-(triphenylmethyl)-

AG001RXB

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CAS Number	160446-35-5
Catalog Number	AG001RXB(AGN-PC-0LZ802)
Chemical Name	1H-Imidazole-4-propanoic acid, 1-(triphenylmethyl)-
IUPAC Name	3-(1-tritylimidazol-4-yl)propanoic acid
InChI	InChI=1S/C25H22N2O2/c28-24(29)17-16-23-18-27(19-26-23)25(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,18-19H,16-17H2,(H,28,29)
InChI Key	WPUNOGRJNPUUQT-UHFFFAOYSA-N
MDL Number	MFCD00237290
Molecular Formula	C25H22N2O2
Molecular Weight	382.4544
SMILES	O=C(O)CCC1=CN(C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C=N1
Synonyms	160446-35-5, 3-(1-Trityl-1H-imidazol-4-yl)propanoic acid, 3-(1-tritylimidazol-4-yl)propanoic Acid, 3-(N-1-TRITYL-IMIDAZOL-4-YL)PROPIONIC ACID, N-1-Trityl-deamino-histidine hydrochloride salt, 1H-Imidazole-4-propanoic acid, 1-(triphenylmethyl)-, N-1-Trityl-dihydrourocanic acid;3-(N-1-Trityl-imidazol-4-yl)-propionic acid, Deamino-His(Trt)-OH, AC1OLRE2, SCHEMBL877785, CTK0H0811, DTXSID30428612, WPUNOGRJNPUUQT-UHFFFAOYSA-N, MFCD00237290, N-1-TRITYL-DEAMINO-HISTIDINE, ZINC36208749, AKOS015901172, 3-(N-Tritylimidazol-4-yl)propionic acid, AK-63858, AS-49164, Z5674, 3-(1-trityl-1h-imidazol-4-yl)-propionic acid, K-5031, 3-(1-Triphenylmethyl-4-imidazolyl)propionic acid, 1H-Imidazole-4-propanoicacid, 1-(triphenylmethyl)-, 1H-Imidazole-4-propanoicacid,1-(triphenylmethyl)-, I14-15390, I14-33108, 3-[1-(triphenylmethyl)-1H-imidazol-4-yl]propanoic acid, N-1-Trityl-deamino-histidine, (3-(N-1-Trityl-imidazol-4-yl)propionic acid, N-1-Trityl-dihydrourocanic acid, C25H22N2O2, CID7408442,

Complexity	473
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	382.168g/mol
Formal Charge	0
Heavy Atom Count	29
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	382.463g/mol
Monoisotopic Mass	382.168g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	55.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number