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Structure

2-(1-Phenylethyl)phenyl dihydrogen phosphate

CAS
94200-31-4
Catalog Number
ACM94200314
Category
Other Products
Molecular Weight
278.240261 [g/mol]
Molecular Formula
C14H15O4P

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Specification

Synonyms
EINECS 303-507-8, 2-(1-Phenylethyl)phenyl dihydrogen phosphate, 94200-31-4
IUPAC Name
[2-(1-phenylethyl)phenyl] dihydrogen phosphate
Canonical SMILES
CC(C1=CC=CC=C1)C2=CC=CC=C2OP(=O)(O)O
InChI Key
FYMUMQJGVYLCJF-UHFFFAOYSA-N
Boiling Point
453ºC at 760mmHg
Flash Point
227.8ºC
Density
1.307g/cm³
EC Number
303-507-8
Exact Mass
278.07100
H-Bond Acceptor
4
H-Bond Donor
2
What is the molecular formula of 2-(1-Phenylethyl)phenyl dihydrogen phosphate?

The molecular formula of 2-(1-Phenylethyl)phenyl dihydrogen phosphate is C14H15O4P.

When was 2-(1-Phenylethyl)phenyl dihydrogen phosphate created and modified in PubChem?

It was created on July 11, 2007, and last modified on December 30, 2023.

What is the IUPAC name of 2-(1-Phenylethyl)phenyl dihydrogen phosphate?

The IUPAC name is [2-(1-phenylethyl)phenyl] dihydrogen phosphate.

What is the InChIKey of 2-(1-Phenylethyl)phenyl dihydrogen phosphate?

The InChIKey is FYMUMQJGVYLCJF-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 2-(1-Phenylethyl)phenyl dihydrogen phosphate have?

It has 2 hydrogen bond donor counts.

What is the topological polar surface area of 2-(1-Phenylethyl)phenyl dihydrogen phosphate?

The topological polar surface area is 66.8 Ų.

Does 2-(1-Phenylethyl)phenyl dihydrogen phosphate have any defined atom stereocenter counts?

No, it does not have any defined atom stereocenter counts.

What is the complexity of 2-(1-Phenylethyl)phenyl dihydrogen phosphate?

The complexity value is 321.

How many covalently-bonded unit counts does 2-(1-Phenylethyl)phenyl dihydrogen phosphate have?

It has 1 covalently-bonded unit count.

Is 2-(1-Phenylethyl)phenyl dihydrogen phosphate canonicalized?

Yes, the compound is canonicalized in PubChem.

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