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Sodium iodoacetate

Sodium iodoacetate structure

CAS No:
305-53-3
Formula:
C2H3IO2.Na
Chemical Name:
Sodium iodoacetate
Synonyms:
Acetic acid,2-iodo-,sodium salt (1:1);Acetic acid,iodo-,sodium salt;Sodium iodoacetate;Sodium monoiodoacetate;Iodoacetic acid sodium salt
Categories:
Organic Chemistry > Organometallic Compounds

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Description

light yellow to yellow-brown powder

A derivative of ACETIC ACID that contains one IODINE atom attached to its methyl group.

Sodium iodoacetate Basic Attributes

Molecular Weight：

207.93

Exact Mass：

207.899704

EC Number：

206-165-7

UNII：

07814F2QRI

DSSTox ID：

DTXSID0059790

HScode：

2915900090

Characteristics

PSA：

40.13000

XLogP3：

-0.82870

Appearance：

Light yellow to yellow-brown Powder

Melting Point：

208 °C (dec.)(lit.)

Boiling Point：

262.1ºC at 760mmHg

Flash Point：

112.3ºC

Water Solubility：

methanol: 0.1 M at 20 °C, clear, colorless

Storage Conditions：

−20°C

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

UN 2811 6.1/PG 1

wgk germany：

hazard class code：

25-37/38-41-20/21/22-36/37/38

safety instructions：

26-39-45-36-36/37/39-22

RTECS Number：

AI3675000

Marks：

T,Xn

Precautionary statement(s)：

P261-P280-P301 + P310-P305 + P351 + P338

Hazard Statements：

H301-H315-H318-H335

Drug Information

MeSH：

Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)

MeSH Entry Terms：

Acid, Iodoacetic

Sodium iodoacetate Use and Manufacturing

Uses

For the pharmaceutical industry

Manufacturing Info：

Acetic acid, 2-iodo-, sodium salt (1:1): ACTIVE

Computed Properties

Molecular Weight:207.93
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:207.89972
Monoisotopic Mass:207.89972
Topological Polar Surface Area:40.1
Heavy Atom Count:6
Complexity:46.8
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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