AG007G0M

324756-80-1 | 5-Methoxy-3-formylindole-1-carboxylic acid tert-butyl ester

AG007G0M

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CAS Number	324756-80-1
Catalog Number	AG007G0M(AGN-PC-00PCQT)
Chemical Name	5-Methoxy-3-formylindole-1-carboxylic acid tert-butyl ester
IUPAC Name	tert-butyl 3-formyl-5-methoxyindole-1-carboxylate
InChI	InChI=1S/C15H17NO4/c1-15(2,3)20-14(18)16-8-10(9-17)12-7-11(19-4)5-6-13(12)16/h5-9H,1-4H3
InChI Key	RVKRRKYBGKPJDF-UHFFFAOYSA-N
MDL Number	MFCD05864693
Molecular Formula	C15H17NO4
Molecular Weight	275.2998
SMILES	O=C(N1C=C(C=O)C2=C1C=CC(OC)=C2)OC(C)(C)C
Synonyms	324756-80-1, tert-Butyl 3-formyl-5-methoxy-1H-indole-1-carboxylate, 1-Boc-5-Methoxy-3-formylindole, 5-Methoxy-3-formylindole-1-carboxylic acid tert-butyl ester, AK-16407, PubChem9124, formylmethoxyindolecarboxylate, tert-butyl 3-formyl-5-methoxyindole-1-carboxylate, SCHEMBL4376044, CTK4G8766, KS-00001SIQ, DTXSID70573074, RVKRRKYBGKPJDF-UHFFFAOYSA-N, ZINC2563717, ZX-AT009811, ANW-52166, MFCD05864693, OR1659, SBB066673, AKOS005069608, MB03652, RP15296, RTR-013643, ACM324756801, AJ-40834, AN-28808, BR-16407, AX8104513, TR-013643, 4CH-006655, AM20060987, FT-0651633, ST24033326, W5428, tert-butyl 3-formyl-5-methoxyindolecarboxylate, S-2073, 3-Formyl-5-methoxy-1H-indole, N-BOC protected, 3-FORMYL-5-METHOXYINDOLE, N-BOC PROTECTED, A821291, 11Z-0701, I10-0176, J-524543, t-butyl 3-formyl-5-methoxy-1h-indole-1-carboxylate, tert-butyl 3-formyl-5-methoxy-indole-1-carboxylate, tert-butyl 3-methanoyl-5-methoxy-indole-1-carboxylate, 1-(tert-Butoxycarbonyl)-5-methoxy-1H-indole-3-carbaldehyde, 3-formyl-5-methoxy-1-indolecarboxylic acid tert-butyl ester, 1H-Indole-1-carboxylicacid, 3-formyl-5-methoxy-, 1,1-dimethylethyl ester, C15H17NO4, 1-Boc-5-METHOXYINDOLE-3-CARBOXALDEHYDE, 5-METHOXY-3-FORMYLINDOLE-1-CARBOXYLICACIDTERT-BUTYLESTER, 387-44-0,

Complexity	377
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	275.116g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	275.304g/mol
Monoisotopic Mass	275.116g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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