CAS
954219-68-2 Purity
96%
954219-68-2 Purity
96%
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3-(3-Methoxyphenoxy)azetidine x1hcl
CAS
954220-79-2
Catalog Number
ACM954220792
Category
Other Products
Molecular Weight
179.215720 [g/mol]
Molecular Formula
C10H13NO2
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Specification
Synonyms
3-(3-METHOXYPHENOXY)AZETIDINE, 954220-79-2, Ambcb4026707, SureCN1923468, CTK7A9837, MolPort-002-053-772, AKOS012079591, AG-L-53182, MCULE-7304751586, QC-7421, AK-71520
IUPAC Name
3-(3-methoxyphenoxy)azetidine
Canonical SMILES
COC1=CC=CC(=C1)OC2CNC2
InChI Key
QRHBRUDGTZWRJB-UHFFFAOYSA-N
Exact Mass
179.09500
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of the compound with PubChem CID 22309141?
The molecular formula is C10H13NO2.
What is the molecular weight of the compound?
The molecular weight is 179.22 g/mol.
What are the synonyms of the compound?
The synonyms include 3-(3-Methoxyphenoxy)azetidine and DIPICOLINICACIDN-OXIDE.
When was the compound created in PubChem?
The compound was created on December 5, 2007.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES representation is COC1=CC(=CC=C1)OC2CNC2.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
What is the topological polar surface area of the compound?
The topological polar surface area is 30.5 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the InChIKey of the compound?
The InChIKey is QRHBRUDGTZWRJB-UHFFFAOYSA-N.
How many rotatable bond counts does the compound have?
The compound has 3 rotatable bond counts.
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CAS
95422-24-5 Purity
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95422-24-5 Purity
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