CAS
95656-88-5 Purity
97%
95656-88-5 Purity
97%
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3-Hydroxy-5-methylbenzonitrile
CAS
95658-81-4
Catalog Number
ACM95658814
Category
Other Products
Molecular Weight
133.147280 [g/mol]
Molecular Formula
C8H7NO
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Specification
Synonyms
3-Hydroxy-5-methylbenzonitrile, 95658-81-4, 3-Cyano-5-methylphenol, SureCN509567, CTK8C0129, 3-CYANO-5-HYDROXYTOLUENE, ANW-64182, AKOS015891318, MB25636, AK-92963, BD218745, KB-31420, FT-0687036, I01-9757
IUPAC Name
3-hydroxy-5-methylbenzonitrile
Canonical SMILES
CC1=CC(=CC(=C1)C#N)O
InChI Key
OATUMQZBLZQKBX-UHFFFAOYSA-N
Exact Mass
133.05300
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 3-Hydroxy-5-methylbenzonitrile?
The molecular formula of 3-Hydroxy-5-methylbenzonitrile is C8H7NO.
What are the synonyms for 3-Hydroxy-5-methylbenzonitrile?
The synonyms for 3-Hydroxy-5-methylbenzonitrile are 95658-81-4, 3-Cyano-5-methylphenol, Benzonitrile, 3-hydroxy-5-methyl, and SCHEMBL509567.
When was 3-Hydroxy-5-methylbenzonitrile created in PubChem?
3-Hydroxy-5-methylbenzonitrile was created on December 5, 2007.
What is the molecular weight of 3-Hydroxy-5-methylbenzonitrile?
The molecular weight of 3-Hydroxy-5-methylbenzonitrile is 133.15 g/mol.
What is the IUPAC name of 3-Hydroxy-5-methylbenzonitrile?
The IUPAC name of 3-Hydroxy-5-methylbenzonitrile is 3-hydroxy-5-methylbenzonitrile.
What is the InChIKey of 3-Hydroxy-5-methylbenzonitrile?
The InChIKey of 3-Hydroxy-5-methylbenzonitrile is OATUMQZBLZQKBX-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 3-Hydroxy-5-methylbenzonitrile have?
3-Hydroxy-5-methylbenzonitrile has 1 hydrogen bond donor count.
What is the topological polar surface area of 3-Hydroxy-5-methylbenzonitrile?
The topological polar surface area of 3-Hydroxy-5-methylbenzonitrile is 44?2.
How many rotatable bond counts does 3-Hydroxy-5-methylbenzonitrile have?
3-Hydroxy-5-methylbenzonitrile has 0 rotatable bond counts.
Is 3-Hydroxy-5-methylbenzonitrile a canonicalized compound?
Yes, 3-Hydroxy-5-methylbenzonitrile is a canonicalized compound.
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