Viewing Compound With Structures

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Compound Report Overview

Compound Name: CHLOROBUTANOL
Compound Identifier: 707673
Mol Structure 2D: 707673
Molecular Weight: 177
Formula: C4 H7 Cl3 O
Development Status: US FDA Approved
SMILES: CC(C)(O)C(Cl)(Cl)Cl
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222072D 0 0.00000 0.00000 0^^ 8 7 0 0 0 999 V2000^ -0.6208 0.0833 0.0000 C 0 0 3 0 0 0 0 0 0^ 0.8042 0.1458 0.0000 C 0 0 3 0 0 0 0 0 0^ -1.0625 1.4458 0.0000 Cl 0 0 0 0 0 0 0 0 0^ -2.0250 -0.2375 0.0000 Cl 0 0 0 0 0 0 0 0 0^ -0.4208 -1.3417 0.0000 Cl 0 0 0 0 0 0 0 0 0^ 1.2417 -1.2125 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.2042 0.4625 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6042 1.5625 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 1 1 0 0 0^ 4 1 1 0 0 0^ 5 1 1 0 0 0^ 6 2 1 0 0 0^ 7 2 1 0 0 0^ 8 2 1 0 0 0^M END^^
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