CAS
952319-70-9 Purity
96%
952319-70-9 Purity
96%
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Cyclohexanecarboxylicacid,4-methoxy-
CAS
95233-12-8
Catalog Number
ACM95233128
Category
Other Products
Molecular Weight
158.19
Molecular Formula
C8H14O3
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Specification
Synonyms
4-METHOXYCYCLOHEXANECARBOXYLIC ACID, 95233-12-8, SBB053474, 4-methoxycyclohexane-1-carboxylic Acid, 4-Methoxycyclohexanecarboxylic acid, mixture of cis and trans, 4-methoxy-cyclohexanecarboxylic acid, AC1LEHHC, AC1Q4FEE, SureCN322695, SureCN1979948, SureCN2444574, 332844_ALDRICH, CTK2H0825, CTK3I5993, MolPort-001-794-402, Cyclohexanecarboxylicacid, 4-methoxy-, AKOS015894344, AG-H-92308, AK112920, KB-242588
IUPAC Name
4-methoxycyclohexane-1-carboxylic acid
Canonical SMILES
COC1CCC(CC1)C(=O)O
InChI Key
WKILSRYNRQGRMA-UHFFFAOYSA-N
Boiling Point
266.6ºC at 760mmHg
Flash Point
105.3ºC
Density
1.09g/cm³
Exact Mass
158.09400
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
1
Safety Description
26-37/39
What is the molecular formula of Cyclohexanecarboxylic acid, 4-methoxy?
The molecular formula is C8H14O3.
What is the molecular weight of Cyclohexanecarboxylic acid, 4-methoxy?
The molecular weight is 158.19 g/mol.
What is the IUPAC name of Cyclohexanecarboxylic acid, 4-methoxy?
The IUPAC name is 4-methoxycyclohexane-1-carboxylic acid.
What is the InChI of Cyclohexanecarboxylic acid, 4-methoxy?
The InChI is InChI=1S/C8H14O3/c1-11-7-4-2-6(3-5-7)8(9)10/h6-7H,2-5H2,1H3,(H,9,10).
What is the InChIKey of Cyclohexanecarboxylic acid, 4-methoxy?
The InChIKey is WKILSRYNRQGRMA-UHFFFAOYSA-N.
What is the canonical SMILES of Cyclohexanecarboxylic acid, 4-methoxy?
The canonical SMILES is COC1CCC(CC1)C(=O)O.
What is the CAS number of Cyclohexanecarboxylic acid, 4-methoxy?
The CAS number is 95233-12-8.
What is the European Community (EC) Number of Cyclohexanecarboxylic acid, 4-methoxy?
The European Community (EC) Number is 628-803-7.
How many hydrogen bond donor counts does Cyclohexanecarboxylic acid, 4-methoxy have?
It has 1 hydrogen bond donor count.
How many rotatable bond counts does Cyclohexanecarboxylic acid, 4-methoxy have?
It has 2 rotatable bond counts.
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