Consensus flow list

1-chloro-2-nitro-propane

fo-54063efa025c5022

Identity

Type
NeutralMolecule
CAS
2425-66-3
EC
—
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 1-chloro-2-nitro-propane

Alternative labels

5

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string FPJNQQRSBJPGHM-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C3H6ClNO2/c1-3(2-4)5(6)7/h3H,2H2,1H3
IUPAC name chemrof:IUPAC_name 1-chloro-2-nitro-propane
Molecular formula chemrof:molecular_formula C3H6ClNO2
Molecular mass chemrof:molecular_mass 123.539
Monoisotopic mass chemrof:monoisotopic_mass 123.008706
SMILES string chemrof:smiles_string CC(CCl)[N+](=O)[O-]

Known URLs

7

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=2425-66-3 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6041264 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=17667 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/K2GZ49H7NP enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.889A enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/17044 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27281859 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
4ad7cb6d-aea2-4933-8b1e-86981473b5c0 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
e3e612c5-4c1e-48e8-9551-e95a5cb45a68 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
c478c1a8-7f5b-46ef-ab2f-82237022ab0b Environmental → Air → Indoor EF 3.1 kg 2
9a1c9bc0-4960-4874-874d-8f14d675d1fe Environmental → Air → Long-term EF 3.1 kg 0
c7fee6dc-bee9-4e56-8fc0-cc796773bb76 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
49ea5821-eeb2-41a5-b3d4-c1b0b54b202f Environmental → Air → Unknown EF 3.1 kg 2
1591bcac-2e68-434f-8b39-6c5f2d45f887 Environmental → Ground → Agricultural EF 3.1 kg 2
8bd2f56c-9746-4ac6-a4d7-48920432aad5 Environmental → Ground → Non-agricultural EF 3.1 kg 2
e57461ec-2796-403c-a824-58c06f33418a Environmental → Ground → Unknown EF 3.1 kg 2
2214be2c-ab9c-477a-b60a-6eb0798e6535 Environmental → Water → Long-term EF 3.1 kg 0
995259a1-ffc1-401a-b570-6738d84c359e Environmental → Water → Ocean EF 3.1 kg 2
60fed37c-80aa-4619-9c79-db911f181adb Environmental → Water → Surface water EF 3.1 kg 2
2e94a781-c4bc-431a-91b5-edd318c003d0 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON 
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}

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