Butoxypropanol

: Iupac Name：3-butoxypropan-1-ol; CAS No.: 63716-40-5; Molecular Weight：132.20074; Modify Date.: 2022-11-23 23:41; Introduction:
Colorless liquid. Soluble in water. Combustible.
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1. Names and Identifiers

: 1.1 Name; Butoxypropanol; 1.2 Synonyms; 3-butoxy propan-1-ol 3-Butoxy-1-propanol 3-butoxypropan-1-ol ACN-053361 AKOS005292554 BCP22340 BRN 1734195 CTK0H8292 Dowanol 37B DTXSID4075453 n-Butoxy-1-propanol N-Butoxypropanol (mixed isomer) NSC 221254 NSC221254 Propanediol butyl ethe Propanol, butoxy- (mixed isomers) Propylene glycol mono-n-butyl ether Q-200365 WLN: Q3O4 ZINC1755956; View all

2. Properties

3. Safety and Handling

3.1 Safety Statements: Moderately toxic by ingestion and skin contact. A mild skin and severe eye irritant. When heated to decomposition it emits acrid smoke and irritating fumes.

4. Other Information

4.0 Storage features: The warehouse is ventilated, low temperature and dry; it is not easy to store for a long time to prevent the formation of peroxide

5. Computational chemical data

Molecular Weight: 132.20074g/mol
Molecular Formula: C₇H₁₆O₂
Compound Is Canonicalized: True
XLogP3-AA: 1
Exact Mass: 132.115029749
Monoisotopic Mass: 132.115029749
Complexity: 46.2
Rotatable Bond Count: 6
Hydrogen Bond Donor Count: 1
Hydrogen Bond Acceptor Count: 2
Topological Polar Surface Area: 29.5
Heavy Atom Count: 9
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADceBgMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACACggAICAAAABgAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAACQAAFAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

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