CAS
91064-26-5 Purity
96%
91064-26-5 Purity
96%
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6-Bromonaphthalene-1-carbonitrile
CAS
91065-16-6
Catalog Number
ACM91065166
Category
Other Products
Molecular Weight
232.07604
Molecular Formula
C11H6BrN
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Specification
Synonyms
6-Bromonaphthalene-1-carbonitrile
IUPAC Name
6-bromonaphthalene-1-carbonitrile
Canonical SMILES
C1=CC(=C2C=CC(=CC2=C1)Br)C#N
InChI Key
HDMVMVPNLKOXTK-UHFFFAOYSA-N
Exact Mass
230.96800
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of 6-Bromonaphthalene-1-carbonitrile?
The molecular formula is C11H6BrN.
When was 6-Bromonaphthalene-1-carbonitrile created according to PubChem?
It was created on 2007-12-05.
What is the molecular weight of 6-Bromonaphthalene-1-carbonitrile?
The molecular weight is 232.08 g/mol.
What is the InChIKey of 6-Bromonaphthalene-1-carbonitrile?
The InChIKey is HDMVMVPNLKOXTK-UHFFFAOYSA-N.
How many hydrogen bond donor counts are there in 6-Bromonaphthalene-1-carbonitrile?
There are 0 hydrogen bond donor counts.
What is the topological polar surface area of 6-Bromonaphthalene-1-carbonitrile?
The topological polar surface area is 23.8 Å2.
Does 6-Bromonaphthalene-1-carbonitrile have any defined atom stereocenter count?
No, it does not have any defined atom stereocenter count.
How many heavy atoms are there in 6-Bromonaphthalene-1-carbonitrile?
There are 13 heavy atoms.
Is 6-Bromonaphthalene-1-carbonitrile a covalently-bonded unit?
Yes, it is a covalently-bonded unit.
What is the xLogP3-AA value of 6-Bromonaphthalene-1-carbonitrile?
The xLogP3-AA value is 3.6.
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