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Hexanoic acid, 2-ethyl-, zirconium(4+) salt (4:1)

Hexanoic acid, 2-ethyl-, zirconium(4+) salt (4:1) structure

CAS No:
2233-42-3
Formula:
C8H16O2.¹/4Zr
Chemical Name:
Hexanoic acid, 2-ethyl-, zirconium(4+) salt (4:1)
Synonyms:
Hexanoic acid,2-ethyl-,zirconium(4+) salt (4:1);Hexanoic acid,2-ethyl-,zirconium(4+) salt;Zirconium 2-ethylhexanoate;Zirconium(IV) 2-ethylhexanoate;Nikka Octhix Zirconium;CXZR 043;Orgatix ZC 200;95612-31-0;2363134-01-2
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Hexanoic acid, 2-ethyl-, zirconium(4+) salt (4:1) Basic Attributes

Molecular Weight：

664.03800

Exact Mass：

662.33400

EC Number：

218-776-6

Characteristics

PSA：

105.20000

XLogP3：

8.84120

Boiling Point：

228ºC at 760mmHg

Flash Point：

116.6ºC

Safety Information

Precautionary statement(s)：

P201, P202, P281, P308+P313, P405, P501

Hazard Statements：

H361

GHS Classification：

|Warning|H361 (100%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]|P201, P202, P281, P308+P313, P405, and P501|Aggregated GHS information provided by 4 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:664.0
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:16
Exact Mass:662.333518
Monoisotopic Mass:662.333518
Topological Polar Surface Area:161
Heavy Atom Count:41
Complexity:93.9
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:5
Compound Is Canonicalized:Yes

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Guide of Hexanoic acid, 2-ethyl-, zirconium(4+) salt (4:1)

Basic Attributes
Characteristics
Safety Information
Computed Properties
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