U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C5H11O3P.2Na
Molecular Weight 196.0923
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DISODIUM PENTYLPHOSPHONATE

SMILES

[Na+].[Na+].CCCCCP([O-])([O-])=O

InChI

InChIKey=HLTIWJKLEJQDJY-UHFFFAOYSA-L
InChI=1S/C5H13O3P.2Na/c1-2-3-4-5-9(6,7)8;;/h2-5H2,1H3,(H2,6,7,8);;/q;2*+1/p-2

HIDE SMILES / InChI

Molecular Formula C5H11O3P
Molecular Weight 150.1128
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:10:58 GMT 2025
Edited
by admin
on Mon Mar 31 23:10:58 GMT 2025
Record UNII
1219T08QQU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHOSPHONIC ACID, PENTYL-, DISODIUM SALT
Preferred Name English
DISODIUM PENTYLPHOSPHONATE
Systematic Name English
Code System Code Type Description
PUBCHEM
87402949
Created by admin on Mon Mar 31 23:10:58 GMT 2025 , Edited by admin on Mon Mar 31 23:10:58 GMT 2025
PRIMARY
FDA UNII
1219T08QQU
Created by admin on Mon Mar 31 23:10:58 GMT 2025 , Edited by admin on Mon Mar 31 23:10:58 GMT 2025
PRIMARY
CAS
29329-65-5
Created by admin on Mon Mar 31 23:10:58 GMT 2025 , Edited by admin on Mon Mar 31 23:10:58 GMT 2025
NON-SPECIFIC STOICHIOMETRY
CAS
106539-31-5
Created by admin on Mon Mar 31 23:10:58 GMT 2025 , Edited by admin on Mon Mar 31 23:10:58 GMT 2025
PRIMARY