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3-Iodopropionic acid

3-Iodopropionic acid structure

CAS No:
141-76-4
Formula:
C3H5IO2
Chemical Name:
3-Iodopropionic acid
Synonyms:
Propanoic acid,3-iodo-;Propionic acid,3-iodo-;3-Iodopropanoic acid;3-Iodopropionic acid;β-Iodopropionic acid;NSC 2124
Categories:
Chemical Reagents > Organic Reagents

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Description

Solid

3-Iodopropanoic acid is a member of piperidines.

3-Iodopropionic acid Basic Attributes

Molecular Weight：

199.98

Exact Mass：

199.98

BRN：

1699514

EC Number：

205-499-0

NSC Number：

2124

DSSTox ID：

DTXSID8059710

HScode：

2915900090

Characteristics

PSA：

37.30000

XLogP3：

1.04

Appearance：

Solid

Density：

2.2±0.1 g/cm3

Melting Point：

81.5 °C

Boiling Point：

259.7±23.0 °C at 760 mmHg

Flash Point：

110.9±22.6 °C

Refractive Index：

1.581

Water Solubility：

74.3 mg/mL at 25 °C

Vapor Pressure：

0.00383mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 3261 8/PG 2

wgk germany：

hazard class code：

safety instructions：

26-27-28-36/37/39-45

RTECS Number：

UF4900000

Marks：

Precautionary statement(s)：

P280-P305 + P351 + P338-P310

Hazard Statements：

H314

GHS Classification：

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 44 companies from 3 notifications to the ECHA C&L Inventory.|Not Classified

3-Iodopropionic acid Use and Manufacturing

Manufacturing Info：

Propanoic acid, 3-iodo-: ACTIVE

Computed Properties

Molecular Weight:199.97
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:199.93343
Monoisotopic Mass:199.93343
Topological Polar Surface Area:37.3
Heavy Atom Count:6
Complexity:52.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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