Products for Research Use Only

2-Chloro-5-methylphenol

CAT: 0572-TRC-C369725-5GSize: 5 gDry Ice: NoHazardous: Yes
Product image 1
1 / 1
CAT#:0572-TRC-C369725-5GSize:5 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
615-74-7
Hazard Statement
Causes skin irritation; UN number: UN3437; Packing Group: II
Smiles
Cc1ccc(Cl)c(O)c1
Molecular Formula
C7 H7 Cl O
Molecular Weight
142.58
InChI
InChI=1S/C7H7ClO/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,1H3
Additionnal Information
IUPAC name: 2-chloro-5-methylphenol
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

2-Chloro-5-methylphenol
CAS Number615-74-7
PubChem CID12008
IUPAC Name2-chloro-5-methylphenol
Molecular FormulaC7H7ClO
Molecular Weight142.58
XLogP2.4
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity94
SMILES
CC1=CC(=C(C=C1)Cl)O
InChI
InChI=1S/C7H7ClO/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,1H3
InChIKey
SMFHPCZZAAMJJO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Chloro-5-methylphenol
CAS: 615-74-7
CID: 12008
Formula: C7H7ClO
MW: 142.58
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight142.58
XLogP32.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass142.0185425
Monoisotopic Mass142.0185425
Topological Polar Surface Area20.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity94.9
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