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3562-99-0,MFCD00021539
Catalog No.:AA003I1V
3562-99-0 | 4-(4-Methoxynaphthalen-1-yl)-4-oxobutanoic acid
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100mg
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Technical Information
Catalog Number:
AA003I1V
Chemical Name:
4-(4-Methoxynaphthalen-1-yl)-4-oxobutanoic acid
CAS Number:
3562-99-0
Molecular Formula:
C15H14O4
Molecular Weight:
258.2693
MDL Number:
MFCD00021539
IUPAC Name:
4-(4-methoxynaphthalen-1-yl)-4-oxobutanoic acid
InChI:
InChI=1S/C15H14O4/c1-19-14-8-6-11(13(16)7-9-15(17)18)10-4-2-3-5-12(10)14/h2-6,8H,7,9H2,1H3,(H,17,18)
InChI Key:
FHGJSJFIQNQBCK-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1cccc2)C(=O)CCC(=O)O
UNII:
341YM32546
NSC Number:
53969
Properties
Computed Properties
 
Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.089g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
258.273g/mol
Monoisotopic Mass:
258.089g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Synonyms
 
4-(4-methoxy-1-naphthyl)-4-oxobutyric acid 
Genabil 
Sintobilina 
4-(1-Naphthyl)-4-oxobutanoic acid 
CID71818 
C15-H14-O4 
4-Methoxy-gamma-oxo-1-naphthalenebutanoic acid 
4-(4-Methoxyphthalen-1-yl)-4-oxobutanoic acid 
Epanaftol 
Genabil 
4-(4-methoxynaphthalen-1-yl)-4-oxobutanoic acid 
Nafto-Epatina 
Ido-Genabil 
Fel-Bis 
Methonaphthone 
SC 1749 (as sodium salt) 
Menbutonum [INN-Latin] 
menbutone 
Membutona [INN-Spanish] 
NSC 53969 
Propionic acid, 3-(4-methoxy-1-naphthoyl)- 
UNII-341YM32546 
C15H14O4 
EINECS 222-631-2 
BRN 3059815 
AI3-26003 
SC 1749 [as sodium salt] 
FHGJSJFIQNQBCK-UHFFFAOYSA-N 
Menbutone 
1-Naphthalenebutanoic acid, 4-methoxy-gamma-oxo- 
1-Naphthalenebutanoic acid, 4-methoxy-.gamma.-oxo- 
beta-(1-Methoxy-4-naphthoyl)-propionsaeure [German] 
Acide beta-(1-methoxy-4-naphthoyl)propionique [French] 
NCGC00160573-01 
AK-79196 
341YM32546 
Q-201351 
Menbutonum 
Membutona 
3562-99-0 
Menbutone [BAN:INN] 
Menbutone [INN:BAN] 
Menbutone (INN) 
AC1L2GUV 
beta-(1-Methoxy-4-naphthoyl)-propionsaeure 
Acide beta-(1-methoxy-4-naphthoyl)propionique 
AC1Q47BE 
DSSTox_CID_26240 
DSSTox_RID_81467 
DSSTox_GSID_46240 
Genabilin 
Oprea1_763160 
ZINC446 
4-10-00-03788 (Beilstein Handbook Reference) 
KSC492A2L 
MLS006010865 
Genabiline [veterinary] (TN) 
SCHEMBL1641812 
CHEMBL1972268 
DTXSID8046240 
SC-1749 [As Sodium-Salt] 
Menbuton 
CTK3J2025 
KS-00000NAS 
CHEBI:135064 
HY-B1136 
NSC53969 
Tox21_111910 
4451AB 
ANW-52529 
MFCD00021539 
NSC-53969 
Naftobil 
AKOS005893935 
IMED370793915 
ACM3562990 
CCG-214049 
CS-4741 
MCULE-5757249934 
3-(4'-Methoxynaphthoyl) propionic acid 
AJ-07894 
BC200247 
DS-17627 
Genabilic acid 
SMR002530297 
3-(4-Methoxy-1-naphthoyl)-propionic acid 
CAS-3562-99-0 
AX8080164 
BB0269652 
LS-124739 
RT-000166 
FT-0758399 
.beta.-(1-Methoxy-4-naphthoyl)-propionsaeure 
1-Naphthalenebutanoic acid, 4-methoxy-g-oxo- 
3-(4-Methoxy-1-naphthoyl)propionic acid 
4-(4-Methoxy-1-naphthyl)-4-oxobutanoic acid 
D08178 
4-(4-Methoxy-1-naphthyl)-4-oxobutanoic acid # 
AB01563380_01 
Acide .beta.-(1-methoxy-4-naphthoyl)propionique 
4-(4-Methoxy-naphthalen-1-yl)-4-oxobutyric acid 
SR-01000944287 
I06-2281 
SR-01000944287-1 
menbutone sodium 
Literature
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