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1-Methylcyclopentanol

CAT: 0572-TRC-M295265-5GSize: 5 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-M295265-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1462-03-9
Synonyms
1-Hydroxy-1-methylcyclopentane; 1-Methyl-1-cyclopentanol; 1-Methyl-1-hydroxycyclopentane; 1-Methylcyclopentan-1-ol; 1-Methylcyclopentyl Alcohol; NSC 23230
Hazard Statement
Flammable solid; UN number: UN1325; Packing Group: II
Smiles
CC1(O)CCCC1
Molecular Formula
C6H12O
Molecular Weight
100.16
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

1-Methylcyclopentanol

1-methyl-cyclopentanol is a member of cyclopentanols.

CAS Number1462-03-9
PubChem CID73830
IUPAC Name1-methylcyclopentan-1-ol
Molecular FormulaC6H12O
Molecular Weight100.16
XLogP1
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count7
Formal Charge0
Complexity62
SMILES
CC1(CCCC1)O
InChI
InChI=1S/C6H12O/c1-6(7)4-2-3-5-6/h7H,2-5H2,1H3
InChIKey
CAKWRXVKWGUISE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Methylcyclopentanol
CAS: 1462-03-9
CID: 73830
Formula: C6H12O
MW: 100.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight100.16
XLogP31
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass100.088815002
Monoisotopic Mass100.088815002
Topological Polar Surface Area20.2 Ų
Heavy Atom Count7
Formal Charge0
Complexity62.6
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes