EcoDrugPlus


Keyword(s):	Surfactants
Molecule Category	Salt-form
UNII	0K08L8GE2H
EPA CompTox	DTXSID70880492

Keyword(s):

Surfactants

Molecule Category

Salt-form

UNII

0K08L8GE2H

EPA CompTox

DTXSID70880492


InChI Key	TVACALAUIQMRDF-UHFFFAOYSA-N
Smiles	[Na+].[Na+].CCCCCCCCCCCCO[P]([O-])([O-])=O
InChI	InChI=1S/C12H27O4P.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;;/h2-12H2,1H3,(H2,13,14,15);;/q;2*+1/p-2

InChI Key

TVACALAUIQMRDF-UHFFFAOYSA-N

Smiles

[Na+].[Na+].CCCCCCCCCCCCO[P]([O-])([O-])=O

InChI

InChI=1S/C12H27O4P.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;;/h2-12H2,1H3,(H2,13,14,15);;/q;2*+1/p-2

Property Name	Value
Molecular Formula	C12H27O4P1
Molecular Weight	310.13
AlogP	-3.24
Hydrogen Bond Acceptor	4.0
Number of Rotational Bond	12.0
Polar Surface Area	72.42
Heavy Atoms	19.0

Property Name

Value

Molecular Formula

C12H27O4P1

Molecular Weight

310.13

AlogP

-3.24

Hydrogen Bond Acceptor

4.0

Number of Rotational Bond

12.0

Polar Surface Area

72.42

Heavy Atoms

19.0

Resources	Reference
CAS NUMBER	2627-35-2
NORMAN SUSDAT
FDA SRS	0K08L8GE2H
PubChem	75816
ChemSpider	68325.0

Resources

Reference

CAS NUMBER

2627-35-2

NORMAN SUSDAT

FDA SRS

0K08L8GE2H

PubChem

75816

ChemSpider

68325.0

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

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Last update: Monday, 3 November 2025

DIHYDROGEN MONOLAURYL PHOSPHATE

Structure

Physicochemical Descriptors

Cross References