6-(1,2,3,4-Tetrahydro-1,1,4,4-tetramethyl-6-naphthyl)-2-naphthalenecarboxylic acid

HCID 135754
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Basic information

CAS
86471-16-1
Standard SMILES
CC1(C)CCC(C)(C)c2cc(-c3ccc4cc(C(=O)O)ccc4c3)ccc21
InChIKey
UHFICAKXFHFOCN-UHFFFAOYSA-N
Molecular formula
C25H26O2
Average molar mass
358.5 g/mol
Monoisotopic mass
358.19328007

Names & identifiers

Preferred name
6-(1,2,3,4-Tetrahydro-1,1,4,4-tetramethyl-6-naphthyl)-2-naphthalenecarboxylic acid
IUPAC
6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)naphthalene-2-carboxylic acid
English name
6-(1,2,3,4-tetrahydro-1,1,4,4-tetramethyl-6-naphthyl)-2-naphthalenecarboxylic acid
Molecular formula
C25H26O2
Molecular weight
358.47

Names & synonyms

86471-16-16-(1,2,3,4-Tetrahydro-1,1,4,4-tetramethyl-6-naphthyl)-2-naphthalenecarboxylic acidDTXSID20235579(2,2'-Binaphthalene)-6-carboxylic acid, 5',6',7',8'-tetrahydro-5',5',8',8'-tetramethyl-[2,2'-Binaphthalene]-6-carboxylic acid, 5',6',7',8'-tetrahydro-5',5',8',8'-tetramethyl-RefChem:103955DTXCID00158070CHEMBL25361TTNN5',5',8',8'-Tetramethyl-5',6',7',8'-tetrahydro-[2,2'-binaphthalene]-6-carboxylic acid5',6',7',8'-Tetrahydro-5',5',8',8'-tetramethyl(2,2'-binaphthalene)-6-carboxylic acid6-Ttnnc
Show more names
5',6',7',8'-Tetrahydro-5',5',8',8'-tetramethyl[2,2'-binaphthalene]-6-carboxylic acidCD 135SRI 5898-71RZ9P7E65QASCHEMBL2331952BDBM500482815',5',8',8'-Tetramethyl-5',6',7',8'-tetrahydro[2,2'-binaphthalene]-6-carboxylic acid6-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-2-naphthalenecar-boxylic acid

Database identifiers

CAS
86471-16-1
PubChem CID
135754
DTXSID
DTXSID20235579
ChEMBL
CHEMBL25361
UNII
RZ9P7E65QA
Nikkaji
J431.979F

Properties

Computed structural properties

XLogP
7.5
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
27

Physicochemical properties

FDA UNII
9 P7E65QA · RZ9P7E65QA

Chemistry & industry

Suppliers1 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

Related reactions

1 records
New reaction record

Compound notes

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