1,5-bis(methoxymethoxy)-2-methylanthracene

C19H20O4 — CID 11186038

IUPAC1,5-bis(methoxymethoxy)-2-methylanthracene
SMILESCOCOc1cccc2cc3c(OCOC)c(C)ccc3cc12
InChIInChI=1S/C19H20O4/c1-13-7-8-15-9-16-14(5-4-6-18(16)22-11-20-2)10-17(15)19(13)23-12-21-3/h4-10H,11-12H2,1-3H3
InChIKeyZWRICESNDGYUMW-UHFFFAOYSA-N
MW312.37 g/mol
LogP4.27
Rot. Bonds6

About 1,5-bis(methoxymethoxy)-2-methylanthracene

1,5-bis(methoxymethoxy)-2-methylanthracene (PubChem CID 11186038) has the molecular formula C19H20O4 and a molecular weight of 312.37 g/mol. Its IUPAC name is 1,5-bis(methoxymethoxy)-2-methylanthracene.

Molecular Properties

Compound Name1,5-bis(methoxymethoxy)-2-methylanthracene
PubChem CID11186038
Molecular FormulaC19H20O4
Molecular Weight312.37 g/mol
Exact Mass312.14
IUPAC Name1,5-bis(methoxymethoxy)-2-methylanthracene
SMILESCOCOc1cccc2cc3c(OCOC)c(C)ccc3cc12
InChIInChI=1S/C19H20O4/c1-13-7-8-15-9-16-14(5-4-6-18(16)22-11-20-2)10-17(15)19(13)23-12-21-3/h4-10H,11-12H2,1-3H3
InChIKeyZWRICESNDGYUMW-UHFFFAOYSA-N
XLogP4.27
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2-(1-ethoxyethoxymethyl)-1,5-bis(methoxymethoxy)anthracene
CID 11153821
2-(1-ethoxyethoxymethyl)-1,8-bis(methoxymethoxy)anthracene
CID 11304133
3-methylheptacyclo[25.3.1.12,6.17,11.112,16.117,21.122,26]hexatriaconta-1(30),2,4,6(36),7,9,11(35),12,14,16(34),17(33),18,20,22(32),23,25,27(31),28-octadecaene
CID 171043844
2-fluoro-3-(methoxymethoxy)-1,4-dimethylbenzene
CID 164891583
1,2-bis(methoxymethoxy)-3-phenylbenzene
CID 11000249
4-(methoxymethoxy)-1-benzothiophene
CID 22729028
1-ethynyl-2,3-bis(methoxymethoxy)benzene
CID 24745561
[2-(methoxymethoxy)-3-methylphenyl]boronic acid
CID 44517875
2-(methoxymethoxy)-1-[2-(methoxymethoxy)-6-methylnaphthalen-1-yl]-6-methylnaphthalene
CID 142064515
3-bromo-2-(methoxymethoxy)-1-methylnaphthalene
CID 135380428
1-[(2-methoxynaphthalen-1-yl)methoxy]anthracene
CID 71427905
2-ethyl-1,3-bis(methoxymethoxy)benzene
CID 141101427

Frequently Asked Questions

What is the IUPAC name of 1,5-bis(methoxymethoxy)-2-methylanthracene?
The IUPAC name of 1,5-bis(methoxymethoxy)-2-methylanthracene (CID 11186038) is 1,5-bis(methoxymethoxy)-2-methylanthracene.
What is the SMILES notation for 1,5-bis(methoxymethoxy)-2-methylanthracene?
The canonical SMILES for 1,5-bis(methoxymethoxy)-2-methylanthracene is COCOc1cccc2cc3c(OCOC)c(C)ccc3cc12.
What is the InChIKey of 1,5-bis(methoxymethoxy)-2-methylanthracene?
The InChIKey is ZWRICESNDGYUMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O4/c1-13-7-8-15-9-16-14(5-4-6-18(16)22-11-20-2)10-17(15)19(13)23-12-21-3/h4-10H,11-12H2,1-3H3.
What are the key properties of 1,5-bis(methoxymethoxy)-2-methylanthracene?
1,5-bis(methoxymethoxy)-2-methylanthracene has a molecular weight of 312.37 g/mol, XLogP of 4.27, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-bis(methoxymethoxy)-2-methylanthracene is sourced from PubChem (CID 11186038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).