carbonic acid;1,2,3,4-tetrahydronaphthalene

C11H14O3 — CID 175229813

IUPACcarbonic acid;1,2,3,4-tetrahydronaphthalene
SMILESO=C(O)O.c1ccc2c(c1)CCCC2
InChIInChI=1S/C10H12.CH2O3/c1-2-6-10-8-4-3-7-9(10)5-1;2-1(3)4/h1-2,5-6H,3-4,7-8H2;(H2,2,3,4)
InChIKeyNLCYEEXCLUMEKU-UHFFFAOYSA-N
MW194.23 g/mol
LogP2.79
Rot. Bonds

About carbonic acid;1,2,3,4-tetrahydronaphthalene

carbonic acid;1,2,3,4-tetrahydronaphthalene (PubChem CID 175229813) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is carbonic acid;1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Namecarbonic acid;1,2,3,4-tetrahydronaphthalene
PubChem CID175229813
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Namecarbonic acid;1,2,3,4-tetrahydronaphthalene
SMILESO=C(O)O.c1ccc2c(c1)CCCC2
InChIInChI=1S/C10H12.CH2O3/c1-2-6-10-8-4-3-7-9(10)5-1;2-1(3)4/h1-2,5-6H,3-4,7-8H2;(H2,2,3,4)
InChIKeyNLCYEEXCLUMEKU-UHFFFAOYSA-N
XLogP2.79
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,3,4-tetrahydronaphthalene
CID 174531863
azane;1,2,3,4-tetrahydronaphthalene
CID 22598116
nitric acid;1,2,3,4-tetrahydronaphthalene
CID 21399469
ethane;6,7,8,9-tetrahydro-5H-benzo[7]annulene
CID 143018675
2,3-dihydro-1H-indene;hypobromous acid
CID 174544280
2,3-dihydro-1H-indene;methane
CID 158581717
2,3-dihydro-1H-indene;tetrahydrochloride
CID 175293615
1,4-dihydronaphthalene;1,2,3,4-tetrahydronaphthalene
CID 144945752
acetaldehyde;2,3-dihydro-1H-indene;ethane;1,2,3,4-tetrahydronaphthalene
CID 158377760
2,3,4,5-tetrahydro-1-benzazepine-1-carboxylic acid
CID 90953923
2-hydroperoxy-2-methylpropane;1,2,3,4-tetrahydronaphthalene
CID 174902843
ethane;bis(1,2,3,4-tetrahydronaphthalene);tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene
CID 161259233

Frequently Asked Questions

What is the IUPAC name of carbonic acid;1,2,3,4-tetrahydronaphthalene?
The IUPAC name of carbonic acid;1,2,3,4-tetrahydronaphthalene (CID 175229813) is carbonic acid;1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for carbonic acid;1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for carbonic acid;1,2,3,4-tetrahydronaphthalene is O=C(O)O.c1ccc2c(c1)CCCC2.
What is the InChIKey of carbonic acid;1,2,3,4-tetrahydronaphthalene?
The InChIKey is NLCYEEXCLUMEKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12.CH2O3/c1-2-6-10-8-4-3-7-9(10)5-1;2-1(3)4/h1-2,5-6H,3-4,7-8H2;(H2,2,3,4).
What are the key properties of carbonic acid;1,2,3,4-tetrahydronaphthalene?
carbonic acid;1,2,3,4-tetrahydronaphthalene has a molecular weight of 194.23 g/mol, XLogP of 2.79, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 175229813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).