AG003E22

913836-24-5 | tert-Butyl 4-nitro-1H-indole-1-carboxylate

AG003E22

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	913836-24-5
Catalog Number	AG003E22(AGN-PC-04YJDZ)
Chemical Name	tert-Butyl 4-nitro-1H-indole-1-carboxylate
IUPAC Name	tert-butyl 4-nitroindole-1-carboxylate
InChI	InChI=1S/C13H14N2O4/c1-13(2,3)19-12(16)14-8-7-9-10(14)5-4-6-11(9)15(17)18/h4-8H,1-3H3
InChI Key	UKMLUDGMHPZXGN-UHFFFAOYSA-N
MDL Number	MFCD08689543
Molecular Formula	C13H14N2O4
Molecular Weight	262.2613
SMILES	O=C(N1C=CC2=C1C=CC=C2[N+]([O-])=O)OC(C)(C)C
Synonyms	1-Boc-4-nitroindole, 913836-24-5, tert-butyl 4-nitro-1H-indole-1-carboxylate, tert-butyl 4-nitroindole-1-carboxylate, 4-Nitroindole, N-BOC protected, 4-nitro-indole-1-carboxylic acid tert-butyl ester, n-boc-4-nitroindole, PubChem8947, ACMC-209rb6, SCHEMBL3240302, CTK5G9474, DTXSID30649567, UKMLUDGMHPZXGN-UHFFFAOYSA-N, tert-butyl 4-nitroindolecarboxylate, KS-00000DI1, ZX-AT011886, ANW-39664, MFCD08689543, OR3588, SBB066694, ZINC12471839, 4-nitroindole, n-boc protected 97%, AKOS015836987, QC-8238, RTR-028714, TRA0043068, AJ-62353, AK-82733, AN-26422, CJ-14105, DS-16909, SY007203, AB0050974, AX8057171, TR-028714, FT-0659894, V9052, B-5557, 4-nitro-1-indolecarboxylic acid tert-butyl ester, MFCD08689543 (97+%), 836B245, A843845, I10-0226, C13H14N2O4,

Complexity	372
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	262.095g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	262.265g/mol
Monoisotopic Mass	262.095g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	77A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

Lot Number