AG000BFJ

116026-93-8 | Carbamic acid, N-(3-formyl-4-pyridinyl)-, 1,1-dimethylethyl ester

AG000BFJ

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CAS Number	116026-93-8
Catalog Number	AG000BFJ(AGN-PC-0JWJ8H)
Chemical Name	Carbamic acid, N-(3-formyl-4-pyridinyl)-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl N-(3-formylpyridin-4-yl)carbamate
InChI	InChI=1S/C11H14N2O3/c1-11(2,3)16-10(15)13-9-4-5-12-6-8(9)7-14/h4-7H,1-3H3,(H,12,13,15)
InChI Key	UFWCFTNUYXZYKE-UHFFFAOYSA-N
MDL Number	MFCD01860246
Molecular Formula	C11H14N2O3
Molecular Weight	222.2405
SMILES	O=C(OC(C)(C)C)NC1=C(C=O)C=NC=C1
Synonyms	116026-93-8, tert-Butyl (3-formylpyridin-4-yl)carbamate, tert-Butyl 3-formylpyridin-4-ylcarbamate, Tert-butyl N-(3-formylpyridin-4-yl)carbamate, N-Boc-4-amino-3-pyridinecarboxyaldehyde, N-BOC-4-AMINO-3-FORMYLPYRIDINE, (3-FORMYL-PYRIDIN-4-YL)-CARBAMIC ACID TERT-BUTYL ESTER, AC1LGDO7, 4-(Boc-amino)nicotinaldehyde, SCHEMBL1197794, CTK7I0459, DTXSID40356098, UFWCFTNUYXZYKE-UHFFFAOYSA-N, ZINC335279, 4-(N-Boc-amino)-3-formylpyridine, KS-00000IP2, ANW-46781, MFCD01860246, SBB052228, AKOS015891767, AB10026, CB-3510, CS-W005685, RP05241, RP27387, 4-(BOC-AMINO)-3-FORMYLPYRIDINE, tert-butyl-3-formylpyridin-4-ylcarbamate, AC-23043, AJ-19720, AK-55323, AN-33087, DS-14729, n-boc-4-amino-3-pyridine carboxyaldehyde, SC-32603, ZB010779, RT-014324, TC-135526, 4CH-009479, AM20050687, FT-0658947, ST24031691, tert-butyl N-(3-formyl-4-pyridyl)carbamate, X9146, C-1365, (tert-butoxy)-N-(3-formyl(4-pyridyl))carboxamide, 026B938, I02-1537, J-003369, J-524797, Z1945694955, 4-[n-(tert-butyloxycarbonyl)amino]-3-pyridinecarboxaldehyde, 4-AMINOPYRIDINE-3-CARBOXALDEHYDE, 4-BOC PROTECTED, Carbamic acid, N-(3-formyl-4-pyridinyl)-, 1,1-dimethylethyl ester, C11H14N2O3, CID819566, tert-Butyl(3-formylpyridin-4-yl)carbamate, 773132-83-5,

Complexity	260
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.1g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	222.244g/mol
Monoisotopic Mass	222.1g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	68.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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