AG002YH8

294659-72-6 | Carbamic acid, N-(6-chloro-3-formyl-2-pyridinyl)-, 1,1-dimethylethyl ester

AG002YH8

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CAS Number	294659-72-6
Catalog Number	AG002YH8(AGN-PC-08YJ1H)
Chemical Name	Carbamic acid, N-(6-chloro-3-formyl-2-pyridinyl)-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl N-(6-chloro-3-formylpyridin-2-yl)carbamate
InChI	InChI=1S/C11H13ClN2O3/c1-11(2,3)17-10(16)14-9-7(6-15)4-5-8(12)13-9/h4-6H,1-3H3,(H,13,14,16)
InChI Key	BBWRRFRNWSKWFU-UHFFFAOYSA-N
MDL Number	MFCD10697513
Molecular Formula	C11H13ClN2O3
Molecular Weight	256.6855
SMILES	O=C(OC(C)(C)C)NC1=NC(Cl)=CC=C1C=O
Synonyms	294659-72-6, tert-Butyl 6-chloro-3-formylpyridin-2-ylcarbamate, TERT-BUTYL (6-CHLORO-3-FORMYLPYRIDIN-2-YL)CARBAMATE, tert-butyl N-(6-chloro-3-formylpyridin-2-yl)carbamate, (6-CHLORO-3-FORMYL-PYRIDIN-2-YL)-CARBAMIC ACID TERT-BUTYL ESTER, tert-butyl N-(6-chloro-3-formyl-2-pyridyl)carbamate, SCHEMBL4056822, CTK8B4961, DTXSID80679632, BBWRRFRNWSKWFU-UHFFFAOYSA-N, ANW-46829, MFCD10697513, ZINC65731511, AKOS015998587, AB59797, NE14828, DS-14043, SC-33215, AB0024020, AJ-115581, TC-135574, 4CH-010170, FT-0084038, FT-0660142, J1214, ST24031847, W5200, tert-Butyl(6-chloro-3-formylpyridin-2-yl)carbamate, TERT-BUTYL (6-CHLORO-3-FORMYLPYRIDIN-2-YL)CARBAMAT, Carbamic acid, N-(6-chloro-3-formyl-2-pyridinyl)-, 1,1-dimethylethyl ester, C11H13ClN2O3,

Complexity	291
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	256.061g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	256.686g/mol
Monoisotopic Mass	256.061g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	68.3A^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-H335
Packing Group
Precautionary statements	P261-P264-P270-P271-P280-P301+P312+P330-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
UN Code

Certificate of Analysis

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