Structure

3-(Trifluoromethyl)benzhydrol

CAS
728-80-3
Catalog Number
ACM728803
Category
Alcohols
Molecular Weight
252.23
Molecular Formula
C13H18O2

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Specification

Hazard Statements
H315-H318-H335-H411
RIDADR
NONH for all modes of transport
Symbol
GHS05
What is the molecular formula of 3-(Trifluoromethyl)benzhydrol?

The molecular formula of 3-(Trifluoromethyl)benzhydrol is C14H11F3O.

What is the molecular weight of 3-(Trifluoromethyl)benzhydrol?

The molecular weight of 3-(Trifluoromethyl)benzhydrol is 252.23 g/mol.

What is the IUPAC name of 3-(Trifluoromethyl)benzhydrol?

The IUPAC name of 3-(Trifluoromethyl)benzhydrol is phenyl-[3-(trifluoromethyl)phenyl]methanol.

What is the InChI key of 3-(Trifluoromethyl)benzhydrol?

The InChI key of 3-(Trifluoromethyl)benzhydrol is KRMIEGLFYDWJOT-UHFFFAOYSA-N.

What is the canonical SMILES of 3-(Trifluoromethyl)benzhydrol?

The canonical SMILES of 3-(Trifluoromethyl)benzhydrol is C1=CC=C(C=C1)C(C2=CC(=CC=C2)C(F)(F)F)O.

What is the CAS number of 3-(Trifluoromethyl)benzhydrol?

The CAS number of 3-(Trifluoromethyl)benzhydrol is 728-80-3.

What is the XLogP3-AA value of 3-(Trifluoromethyl)benzhydrol?

The XLogP3-AA value of 3-(Trifluoromethyl)benzhydrol is 3.6.

How many hydrogen bond donor counts does 3-(Trifluoromethyl)benzhydrol have?

3-(Trifluoromethyl)benzhydrol has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 3-(Trifluoromethyl)benzhydrol have?

3-(Trifluoromethyl)benzhydrol has 4 hydrogen bond acceptor counts.

How many rotatable bond counts does 3-(Trifluoromethyl)benzhydrol have?

3-(Trifluoromethyl)benzhydrol has 2 rotatable bond counts.

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