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Details

Stereochemistry RACEMIC
Molecular Formula C4H10NO6P
Molecular Weight 199.0991
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-NITROBUTYL DIHYDROGEN PHOSPHATE

SMILES

CCC(COP(O)(O)=O)[N+]([O-])=O

InChI

InChIKey=TYGGERCVNQVLEJ-UHFFFAOYSA-N
InChI=1S/C4H10NO6P/c1-2-4(5(6)7)3-11-12(8,9)10/h4H,2-3H2,1H3,(H2,8,9,10)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
2-NITROBUTYL DIHYDROGEN PHOSPHATE
Systematic Name English
1-BUTANOL, 2-NITRO-, DIHYDROGEN PHOSPHATE (ESTER)
Common Name English
Code System Code Type Description
CAS
57249-19-1
Created by admin on Sat Dec 16 10:47:17 GMT 2023 , Edited by admin on Sat Dec 16 10:47:17 GMT 2023
PRIMARY
FDA UNII
RL97HLZ676
Created by admin on Sat Dec 16 10:47:17 GMT 2023 , Edited by admin on Sat Dec 16 10:47:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID1058426
Created by admin on Sat Dec 16 10:47:17 GMT 2023 , Edited by admin on Sat Dec 16 10:47:17 GMT 2023
PRIMARY
PUBCHEM
44150130
Created by admin on Sat Dec 16 10:47:17 GMT 2023 , Edited by admin on Sat Dec 16 10:47:17 GMT 2023
PRIMARY
NIH
NCATS
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