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Structure

9-Chloromethylphenanthrene

CAS
951-05-3
Catalog Number
ACM951053
Category
Other Products
Molecular Weight
226.7
Molecular Formula
C15H11Cl

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Specification

Synonyms
9-CHLOROMETHYLPHENANTHRENE;Nsc 82368;Phenanthrene, 9-(chloromethyl)-
IUPAC Name
9-(chloromethyl)phenanthrene
Canonical SMILES
C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)CCl
InChI Key
SYNQYTBSQNSROF-UHFFFAOYSA-N
Boiling Point
402ºC at 760 mmHg
Melting Point
99-101ºC
Flash Point
185ºC
Density
1.223g/cm³
Appearance
White Solid
Exact Mass
226.05500
H-Bond Acceptor
0
H-Bond Donor
0
What is the molecular formula of 9-Chloromethylphenanthrene?

The molecular formula of 9-Chloromethylphenanthrene is C15H11Cl.

When was 9-Chloromethylphenanthrene created and last modified?

9-Chloromethylphenanthrene was created on 2005-03-26 and last modified on 2023-12-30.

What is the IUPAC name of 9-Chloromethylphenanthrene?

The IUPAC name of 9-Chloromethylphenanthrene is 9-(chloromethyl)phenanthrene.

What is the InChIKey of 9-Chloromethylphenanthrene?

The InChIKey of 9-Chloromethylphenanthrene is SYNQYTBSQNSROF-UHFFFAOYSA-N.

What is the Canonical SMILES of 9-Chloromethylphenanthrene?

The Canonical SMILES of 9-Chloromethylphenanthrene is C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)CCl.

What is the CAS number of 9-Chloromethylphenanthrene?

The CAS number of 9-Chloromethylphenanthrene is 951-05-3.

What is the molecular weight of 9-Chloromethylphenanthrene?

The molecular weight of 9-Chloromethylphenanthrene is 226.70 g/mol.

How many heavy atoms are present in 9-Chloromethylphenanthrene?

There are 16 heavy atoms present in 9-Chloromethylphenanthrene.

Is 9-Chloromethylphenanthrene a canonicalized compound?

Yes, 9-Chloromethylphenanthrene is a canonicalized compound.

What is the XLogP3-AA value of 9-Chloromethylphenanthrene?

The XLogP3-AA value of 9-Chloromethylphenanthrene is 4.8.

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