CALCIUM HEXANOATE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	2C6H11O2.Ca
Molecular Weight	270.379
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CALCIUM HEXANOATE

Structure Search

SMILES

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

InChI

InChIKey=BSJIICUVGMPYSD-UHFFFAOYSA-L

InChI=1S/2C6H12O2.Ca/c2*1-2-3-4-5-6(7)8;/h2*2-5H2,1H3,(H,7,8);/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	C6H11O2
Molecular Weight	115.1503
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 `Fri Dec 15 18:17:26 UTC 2023` Edited by `admin` on `Fri Dec 15 18:17:26 UTC 2023`
Record UNII	C2Q55TXK3R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CALCIUM HEXANOATE

Systematic Name

English

CALCIUM N-HEXANOATE

Common Name

English

Code System Code Type Description

FDA UNII

C2Q55TXK3R

Created by admin on Fri Dec 15 18:17:26 UTC 2023 , Edited by admin on Fri Dec 15 18:17:26 UTC 2023

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EPA CompTox

DTXSID70192002

Created by admin on Fri Dec 15 18:17:26 UTC 2023 , Edited by admin on Fri Dec 15 18:17:26 UTC 2023

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PUBCHEM

11687657

Created by admin on Fri Dec 15 18:17:26 UTC 2023 , Edited by admin on Fri Dec 15 18:17:26 UTC 2023

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ECHA (EC/EINECS)

254-096-6

Created by admin on Fri Dec 15 18:17:26 UTC 2023 , Edited by admin on Fri Dec 15 18:17:26 UTC 2023

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CAS

38708-95-1

Created by admin on Fri Dec 15 18:17:26 UTC 2023 , Edited by admin on Fri Dec 15 18:17:26 UTC 2023

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