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6155-68-6 molecular structure
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[(2-hydroxypropanoyl)oxy]zincio 2-hydroxypropanoate

ChemBase ID: 108917
Molecular Formular: C6H10O6Zn
Molecular Mass: 243.52
Monoisotopic Mass: 241.97688004
SMILES and InChIs

SMILES:
CC(O)C(=O)O[Zn]OC(=O)C(C)O
Canonical SMILES:
CC(C(=O)O[Zn]OC(=O)C(O)C)O
InChI:
InChI=1S/2C3H6O3.Zn/c2*1-2(4)3(5)6;/h2*2,4H,1H3,(H,5,6);/q;;+2/p-2
InChIKey:
CANRESZKMUPMAE-UHFFFAOYSA-L

Cite this record

CBID:108917 http://www.chembase.cn/molecule-108917.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
[(2-hydroxypropanoyl)oxy]zincio 2-hydroxypropanoate
IUPAC Traditional name
zinc lactate
Synonyms
D-LACTIC ACID ZINC SALT
DL-Lactic acid hemizinc salt
DL-乳酸 半锌盐
CAS Number
6155-68-6
16039-53-5
EC Number
240-178-9
MDL Number
MFCD00067561
PubChem SID
162094632
PubChem CID
27653

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 27653 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 12.747701  H Acceptors
H Donor LogD (pH = 5.5) -1.4996 
LogD (pH = 7.4) -1.499602  Log P -1.4996 
Molar Refractivity 35.8244 cm3 Polarizability 18.389141 Å3
Polar Surface Area 93.06 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
36/37/38-50/53 expand Show data source
Safety Statements
26-36-61 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS09 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H319-H335-H410 expand Show data source
GHS Precautionary statements
P261-P273-P305 + P351 + P338-P501 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Storage Temperature
2-8°C expand Show data source
Purity
~98% expand Show data source
Certificate of Analysis
Download expand Show data source
Linear Formula
C3H5O3 · 1/2Zn expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05209230 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - L1625 external link
Other Notes
Contains approximately equal amounts of DL isomers.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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