CAS
99-59-2 Purity
97%
99-59-2 Purity
97%
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5-ETHYNYL-2-METHYL-PHENOL
CAS
99595-47-8
Catalog Number
ACM99595478
Category
Other Products
Molecular Weight
132.15922
Molecular Formula
C9H8O
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Specification
Synonyms
5-ETHYNYL-2-METHYL-PHENOL;o-Cresol, 5-ethynyl- (6CI);5-ETHYNYL-1-METHYL-PHENOL
IUPAC Name
5-ethynyl-2-methylphenol
Canonical SMILES
CC1=C(C=C(C=C1)C#C)O
InChI Key
AASVRASIMAZCNX-UHFFFAOYSA-N
Exact Mass
132.05800
H-Bond Acceptor
1
H-Bond Donor
1
What is the molecular formula of 5-ethynyl-2-methyl-phenol?
The molecular formula of 5-ethynyl-2-methyl-phenol is C9H8O.
When was 5-ethynyl-2-methyl-phenol created in PubChem?
5-ethynyl-2-methyl-phenol was created in PubChem on October 30, 2011.
What is the IUPAC name of 5-ethynyl-2-methyl-phenol?
The IUPAC name of 5-ethynyl-2-methyl-phenol is 5-ethynyl-2-methylphenol.
What is the InChIKey of 5-ethynyl-2-methyl-phenol?
The InChIKey of 5-ethynyl-2-methyl-phenol is AASVRASIMAZCNX-UHFFFAOYSA-N.
How many hydrogen bond donor counts does 5-ethynyl-2-methyl-phenol have?
5-ethynyl-2-methyl-phenol has 1 hydrogen bond donor count.
What is the topological polar surface area of 5-ethynyl-2-methyl-phenol?
The topological polar surface area of 5-ethynyl-2-methyl-phenol is 20.2 Ų.
Does 5-ethynyl-2-methyl-phenol have any defined atom stereocenter count?
No, 5-ethynyl-2-methyl-phenol does not have any defined atom stereocenter count.
How many rotatable bond counts does 5-ethynyl-2-methyl-phenol have?
5-ethynyl-2-methyl-phenol has 1 rotatable bond count.
Is the compound 5-ethynyl-2-methyl-phenol canonicalized?
Yes, the compound 5-ethynyl-2-methyl-phenol is canonicalized.
What is the molecular weight of 5-ethynyl-2-methyl-phenol?
The molecular weight of 5-ethynyl-2-methyl-phenol is 132.16 g/mol.
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