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Structure

(S)-(-)-1-(4-Nitrophenyl)ethanol

CAS
96156-72-8
Catalog Number
ACM96156728
Category
Other Products
Molecular Weight
167.16196
Molecular Formula
C8H9NO3

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What is the molecular formula of (S)-(-)-1-(4-Nitrophenyl)ethanol?

The molecular formula is C8H9NO3.

What is the molecular weight of (S)-(-)-1-(4-Nitrophenyl)ethanol?

The molecular weight is 167.16 g/mol.

What is the IUPAC name of (S)-(-)-1-(4-Nitrophenyl)ethanol?

The IUPAC name is (1S)-1-(4-nitrophenyl)ethanol.

What is the InChI of (S)-(-)-1-(4-Nitrophenyl)ethanol?

The InChI is InChI=1S/C8H9NO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-6,10H,1H3/t6-/m0/s1.

What is the InChIKey of (S)-(-)-1-(4-Nitrophenyl)ethanol?

The InChIKey is CRJFHXYELTYDSG-LURJTMIESA-N.

What is the canonical SMILES of (S)-(-)-1-(4-Nitrophenyl)ethanol?

The canonical SMILES is CC(C1=CC=C(C=C1)[N+](=O)[O-])O.

What is the XLogP3 value of (S)-(-)-1-(4-Nitrophenyl)ethanol?

The XLogP3 value is 1.5.

How many hydrogen bond donor counts does (S)-(-)-1-(4-Nitrophenyl)ethanol have?

It has 1 hydrogen bond donor count.

How many rotatable bond counts does (S)-(-)-1-(4-Nitrophenyl)ethanol have?

It has 1 rotatable bond count.

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