Phenol,4-(phenoxymethyl)-(CAS No. 55846-07-6) CAS NO.55846-07-6

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Keywords

Phenol,4-(phenoxymethyl)-
55846-07-6
98%

Quick Details

ProName: Phenol,4-(phenoxymethyl)-(CAS No. 5584...
CasNo: 55846-07-6
Molecular Formula: C13H12 O2
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: According to client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 100 Kilogram/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Kilogram

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Details

【Name】
Phenol,4-(phenoxymethyl)-
【Iupac name】
4-(phenoxymethyl)phenol
【CAS Registry number】
55846-07-6
【Synonyms】
4-(Phenoxymethyl)phenol
NSC 243672
p-(Phenoxymethyl)phenol
【Molecular Formula】
C13H12 O2 (Products with the same molecular formula)
【Molecular Weight】
200.2332
【Inchi】
InChI=1/C13H12O2/c14-12-8-6-11(7-9-12)10-15-13-4-2-1-3-5-13/h1-9,14H,10H2
【Canonical SMILES】
C1=CC=C(C=C1)OCC2=CC=C(C=C2)O
Chemical and Physical Properties
【Density】
1.16g/cm3
【Boiling Point】
352.4°C at 760 mmHg
【Refractive Index】
1.603
【Flash Point】
205.1°C
【Computed Properties】
Molecular Weight:200.23318 [g/mol]
Molecular Formula:C13H12O2
XLogP3:3.4
H-Bond Donor:1
H-Bond Acceptor:2
Rotatable Bond Count:3
Tautomer Count:2
Exact Mass:200.08373
MonoIsotopic Mass:200.08373
Topological Polar Surface Area:29.5
Heavy Atom Count:15
Formal Charge:0
Complexity:167
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Ring Count:2
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:12

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