CALCIUM PENTADECANOATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	2C15H29O2.Ca
Molecular Weight	522.857
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CALCIUM PENTADECANOATE

Structure Search

SMILES

[Ca++].CCCCCCCCCCCCCCC([O-])=O.CCCCCCCCCCCCCCC([O-])=O

InChI

InChIKey=ATCRCMRJRGWPKD-UHFFFAOYSA-L

InChI=1S/2C15H30O2.Ca/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17;/h2*2-14H2,1H3,(H,16,17);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula	Ca
Molecular Weight	40.078
Charge	2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C15H29O2
Molecular Weight	241.3896
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 `Sat Dec 16 08:06:58 GMT 2023` Edited by `admin` on `Sat Dec 16 08:06:58 GMT 2023`
Record UNII	A1WMM8JI6U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CALCIUM PENTADECANOATE

Systematic Name

English

PENTADECANOATE, CALCIUM SALT

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

224-802-7

Created by admin on Sat Dec 16 08:06:58 GMT 2023 , Edited by admin on Sat Dec 16 08:06:58 GMT 2023

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CAS

4499-92-7

Created by admin on Sat Dec 16 08:06:58 GMT 2023 , Edited by admin on Sat Dec 16 08:06:58 GMT 2023

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FDA UNII

A1WMM8JI6U

Created by admin on Sat Dec 16 08:06:58 GMT 2023 , Edited by admin on Sat Dec 16 08:06:58 GMT 2023

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EPA CompTox

DTXSID80196354

Created by admin on Sat Dec 16 08:06:58 GMT 2023 , Edited by admin on Sat Dec 16 08:06:58 GMT 2023

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PUBCHEM

21149324

Created by admin on Sat Dec 16 08:06:58 GMT 2023 , Edited by admin on Sat Dec 16 08:06:58 GMT 2023

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