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PCG (combination)

HCID 174133
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Basic information

CAS
78457-01-9
Standard SMILES
CC(C)(O)C(Cl)(Cl)Cl.COc1ccccc1O
InChIKey
XHXDQAYWNKNTDD-UHFFFAOYSA-N
Molecular formula
C11H15Cl3O3
Average molar mass
301.6 g/mol
Monoisotopic mass
300.008677

Overview

contains phenol, chlorobutanol & guaiacol; used to cauterize bladder to stop bleeding

Names & identifiers

Preferred name
PCG (combination)
IUPAC
2-methoxyphenol;1,1,1-trichloro-2-methylpropan-2-ol
English name
PCG (combination)
Molecular formula
C11H15Cl3O3
Molecular weight
301.594

Names & synonyms

Pcg (combination)78457-01-9DTXSID20229094Phenol, 2-methoxy-, mixt. with phenol and 1,1,1-trichloro-2-methyl-2-propanolRefChem:170496DTXCID401515852-Methoxyphenol--1,1,1-trichloro-2-methylpropan-2-ol (1/1)

Database identifiers

CAS
78457-01-9
PubChem CID
174133
DTXSID
DTXSID20229094

Properties

Computed structural propertiesFilling in

Topological polar surface area
49.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
167

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Compound notes

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