1,1,1-TRIIODO-2-PROPANOL

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C3H5I3O
Molecular Weight	437.7846
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,1,1-TRIIODO-2-PROPANOL

Structure Search

SMILES

CC(O)C(I)(I)I

InChI

InChIKey=ALYGJNJDNOFGNM-UHFFFAOYSA-N

InChI=1S/C3H5I3O/c1-2(7)3(4,5)6/h2,7H,1H3

HIDE SMILES / InChI

Molecular Formula	C3H5I3O
Molecular Weight	437.7846
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:02:18 GMT 2023` Edited by `admin` on `Sat Dec 16 08:02:18 GMT 2023`
Record UNII	46OU07249E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,1,1-TRIIODO-2-PROPANOL

Systematic Name

English

2-PROPANOL, 1,1,1-TRIIODO-

Systematic Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

46927

Created by admin on Sat Dec 16 08:02:18 GMT 2023 , Edited by admin on Sat Dec 16 08:02:18 GMT 2023

Code System Code Type Description

EPA CompTox

DTXSID5058484

Created by admin on Sat Dec 16 08:02:18 GMT 2023 , Edited by admin on Sat Dec 16 08:02:18 GMT 2023

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PUBCHEM

44154688

Created by admin on Sat Dec 16 08:02:18 GMT 2023 , Edited by admin on Sat Dec 16 08:02:18 GMT 2023

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CAS

82010-76-2

Created by admin on Sat Dec 16 08:02:18 GMT 2023 , Edited by admin on Sat Dec 16 08:02:18 GMT 2023

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FDA UNII

46OU07249E

Created by admin on Sat Dec 16 08:02:18 GMT 2023 , Edited by admin on Sat Dec 16 08:02:18 GMT 2023

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