(1-methoxycyclooctyl)methanol

C10H20O2 — CID 165494656

IUPAC(1-methoxycyclooctyl)methanol
SMILESCOC1(CO)CCCCCCC1
InChIInChI=1S/C10H20O2/c1-12-10(9-11)7-5-3-2-4-6-8-10/h11H,2-9H2,1H3
InChIKeyNBRUNAMLBCXVLL-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.11
Rot. Bonds2

About (1-methoxycyclooctyl)methanol

(1-methoxycyclooctyl)methanol (PubChem CID 165494656) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is (1-methoxycyclooctyl)methanol.

Molecular Properties

Compound Name(1-methoxycyclooctyl)methanol
PubChem CID165494656
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name(1-methoxycyclooctyl)methanol
SMILESCOC1(CO)CCCCCCC1
InChIInChI=1S/C10H20O2/c1-12-10(9-11)7-5-3-2-4-6-8-10/h11H,2-9H2,1H3
InChIKeyNBRUNAMLBCXVLL-UHFFFAOYSA-N
XLogP2.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1-methoxycyclopropyl)methanol
CID 22889103
1-ethyl-1-methoxycyclohexane
CID 21039859
1-(bromomethyl)-1-methoxycycloheptane
CID 62113509
2-(1-methoxycycloheptyl)ethanamine
CID 83905895
1-(1-methoxycyclopentyl)-N-methylmethanamine
CID 62106218
(1-methoxycyclohexyl)methanesulfonamide
CID 131186704
(1-propoxycyclobutyl)methanol
CID 151153124
(1-methoxycyclobutyl)methanamine
CID 66072375
1-methoxy-1-propylcyclobutane
CID 118668756
(1-methylcyclododecyl)methanol
CID 70130772
1,3-diaminourea;1-methoxy-1-propylcyclohexane
CID 175049010
1-(1-methoxycyclobutyl)-N,N-dimethylmethanamine
CID 178173198

Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclooctyl)methanol?
The IUPAC name of (1-methoxycyclooctyl)methanol (CID 165494656) is (1-methoxycyclooctyl)methanol.
What is the SMILES notation for (1-methoxycyclooctyl)methanol?
The canonical SMILES for (1-methoxycyclooctyl)methanol is COC1(CO)CCCCCCC1.
What is the InChIKey of (1-methoxycyclooctyl)methanol?
The InChIKey is NBRUNAMLBCXVLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-12-10(9-11)7-5-3-2-4-6-8-10/h11H,2-9H2,1H3.
What are the key properties of (1-methoxycyclooctyl)methanol?
(1-methoxycyclooctyl)methanol has a molecular weight of 172.27 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclooctyl)methanol is sourced from PubChem (CID 165494656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).