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18278-24-5 | 1-NAPHTHALENECARBOXALDEHYDE, 1,2,3,4-TETRAHYDRO-
CAS No: 18278-24-5 Catalog No: AG00244I MDL No:MFCD09842496
Product Description
Catalog Number:
AG00244I
Chemical Name:
1-NAPHTHALENECARBOXALDEHYDE, 1,2,3,4-TETRAHYDRO-
CAS Number:
18278-24-5
Molecular Formula:
C11H12O
Molecular Weight:
160.2124
MDL Number:
MFCD09842496
IUPAC Name:
1,2,3,4-tetrahydronaphthalene-1-carbaldehyde
InChI:
InChI=1S/C11H12O/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-2,4,7-8,10H,3,5-6H2
InChI Key:
ZXDOJLXKYNWBMK-UHFFFAOYSA-N
SMILES:
O=CC1CCCc2c1cccc2
NSC Number:
636118
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.089g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.216g/mol
Monoisotopic Mass:
160.089g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| The 3-methylglutaconic acidurias: what's new? | Journal of inherited metabolic disease 20120101 |
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