dichloromethane;phenylmethoxymethylbenzene

C15H16Cl2O — CID 174530379

IUPACdichloromethane;phenylmethoxymethylbenzene
SMILESClCCl.c1ccc(COCc2ccccc2)cc1
InChIInChI=1S/C14H14O.CH2Cl2/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;2-1-3/h1-10H,11-12H2;1H2
InChIKeyMIZFQCSUZCMQEB-UHFFFAOYSA-N
MW283.20 g/mol
LogP4.82
Rot. Bonds4

About dichloromethane;phenylmethoxymethylbenzene

dichloromethane;phenylmethoxymethylbenzene (PubChem CID 174530379) has the molecular formula C15H16Cl2O and a molecular weight of 283.20 g/mol. Its IUPAC name is dichloromethane;phenylmethoxymethylbenzene.

Molecular Properties

Compound Namedichloromethane;phenylmethoxymethylbenzene
PubChem CID174530379
Molecular FormulaC15H16Cl2O
Molecular Weight283.20 g/mol
Exact Mass282.06
IUPAC Namedichloromethane;phenylmethoxymethylbenzene
SMILESClCCl.c1ccc(COCc2ccccc2)cc1
InChIInChI=1S/C14H14O.CH2Cl2/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;2-1-3/h1-10H,11-12H2;1H2
InChIKeyMIZFQCSUZCMQEB-UHFFFAOYSA-N
XLogP4.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.20
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

CID 66734377
CID 66734377
ethane;phenylmethoxymethylbenzene
CID 90943549
dimethyltin;phenylmethoxymethylbenzene
CID 87392963
N-methylmethanamine;phenylmethoxymethylbenzene
CID 70181699
acetic acid;phenylmethoxymethylbenzene
CID 175214238
phenylmethoxymethylbenzene;phosphoric acid
CID 141118417
4-(phenylmethoxymethyl)aniline
CID 11701294
1-ethyl-4-(phenylmethoxymethyl)benzene
CID 123410479
(213C)ethoxymethylbenzene
CID 87947851
disodium;phenylmethoxymethylbenzene;sulfate
CID 70513406
4-(phenylmethoxymethyl)benzenesulfonyl chloride
CID 11066402
[(2R)-3-chloro-2-fluoropropoxy]methylbenzene
CID 69067716

Frequently Asked Questions

What is the IUPAC name of dichloromethane;phenylmethoxymethylbenzene?
The IUPAC name of dichloromethane;phenylmethoxymethylbenzene (CID 174530379) is dichloromethane;phenylmethoxymethylbenzene.
What is the SMILES notation for dichloromethane;phenylmethoxymethylbenzene?
The canonical SMILES for dichloromethane;phenylmethoxymethylbenzene is ClCCl.c1ccc(COCc2ccccc2)cc1.
What is the InChIKey of dichloromethane;phenylmethoxymethylbenzene?
The InChIKey is MIZFQCSUZCMQEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O.CH2Cl2/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;2-1-3/h1-10H,11-12H2;1H2.
What are the key properties of dichloromethane;phenylmethoxymethylbenzene?
dichloromethane;phenylmethoxymethylbenzene has a molecular weight of 283.20 g/mol, XLogP of 4.82, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethane;phenylmethoxymethylbenzene is sourced from PubChem (CID 174530379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).