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Details

Stereochemistry ACHIRAL
Molecular Formula C4H11NO.C4H11O4P
Molecular Weight 243.2377
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTYL DIHYDROGEN PHOSPHATE, COMPOUND WITH 3-METHOXYPROPYLAMINE

SMILES

COCCCN.CCCCOP(O)(O)=O

InChI

InChIKey=BIQGMMVVEHFKFI-UHFFFAOYSA-N
InChI=1S/C4H11NO.C4H11O4P/c1-6-4-2-3-5;1-2-3-4-8-9(5,6)7/h2-5H2,1H3;2-4H2,1H3,(H2,5,6,7)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
BUTYL DIHYDROGEN PHOSPHATE, COMPOUND WITH 3-METHOXYPROPYLAMINE
Systematic Name English
BUTYL DIHYDROGEN PHOSPHATE;3-METHOXYPROPAN-1-AMINE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70240653
Created by admin on Sat Dec 16 19:00:19 GMT 2023 , Edited by admin on Sat Dec 16 19:00:19 GMT 2023
PRIMARY
CAS
94113-77-6
Created by admin on Sat Dec 16 19:00:19 GMT 2023 , Edited by admin on Sat Dec 16 19:00:19 GMT 2023
PRIMARY
PUBCHEM
44147014
Created by admin on Sat Dec 16 19:00:19 GMT 2023 , Edited by admin on Sat Dec 16 19:00:19 GMT 2023
PRIMARY
ECHA (EC/EINECS)
302-611-0
Created by admin on Sat Dec 16 19:00:19 GMT 2023 , Edited by admin on Sat Dec 16 19:00:19 GMT 2023
PRIMARY
FDA UNII
2786BM3HFJ
Created by admin on Sat Dec 16 19:00:19 GMT 2023 , Edited by admin on Sat Dec 16 19:00:19 GMT 2023
PRIMARY
NIH
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