Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate

2-Pyrazinecarboxylic acid, 3-amino-5,6-dichloro-, methyl ester
3-Amino-5,6-dichloropyrazine-2-carboxylic acid methyl ester
Pyrazinecarboxylic acid, 3-amino-5,6-dichloro-, methyl ester

Property	Value
InChI2D key string chemrof:inchi2d_key_string	USYMCUGEGUFUBI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C6H5Cl2N3O2/c1-13-6(12)2-5(9)11-4(8)3(7)10-2/h1H3,(H2,9,11)
IUPAC name chemrof:IUPAC_name	Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate
Molecular formula chemrof:molecular_formula	C6H5Cl2N3O2
Molecular mass chemrof:molecular_mass	222.031
Monoisotopic mass chemrof:monoisotopic_mass	220.975882
SMILES string chemrof:smiles_string	COC(=O)c1nc(Cl)c(Cl)nc1N

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=1458-18-0	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.014.498	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID8057645	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3184300	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3M7GFD6DF2	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J298.644B	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/73828	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q69757027	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
3e1c47a6-060b-4807-bda3-efd1dbbf32b9	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
675f7258-6358-4a57-8e76-265f48c31364	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
c897a15c-ddcc-42f7-97fd-3a2cc8db032a	Environmental → Air → Indoor	EF 3.1	kg	2
19b1a361-1fe7-451c-9948-49c2b943eb7a	Environmental → Air → Long-term	EF 3.1	kg	0
6af1d7da-ae93-4507-93e8-f7567f756f31	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
09233187-3030-482a-853d-9925ced21571	Environmental → Air → Unknown	EF 3.1	kg	2
0263df61-5337-4f72-a3d5-a18b3268796d	Environmental → Ground → Agricultural	EF 3.1	kg	2
d75721dc-4bbe-4c8b-9f5f-43678d141713	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
b885d7bb-3bce-41d3-85b9-1f676c406dbe	Environmental → Ground → Unknown	EF 3.1	kg	2
7712ec1d-4817-4cb1-bf30-388dc0f46a9a	Environmental → Water → Long-term	EF 3.1	kg	0
57f98cf9-10c6-4f98-b2a0-f74dce648365	Environmental → Water → Ocean	EF 3.1	kg	2
9fde5759-6852-40fd-8fa1-e313150df6b2	Environmental → Water → Surface water	EF 3.1	kg	2
9a462547-4d53-44ee-8891-b3b25c452989	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

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Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate

Identity

Structure

Alternative labels

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