Home Other Building Blocks 4-(4-BUTOXYPHENYL)-4-OXOBUTANOIC ACID

4-(4-BUTOXYPHENYL)-4-OXOBUTANOIC ACID

CAS No.:
63471-88-5
Catalog Number:
AG00EB1M
Molecular Formula:
C14H18O4
Molecular Weight:
250.2903
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00EB1M
Chemical Name:
4-(4-BUTOXYPHENYL)-4-OXOBUTANOIC ACID
CAS Number:
63471-88-5
Molecular Formula:
C14H18O4
Molecular Weight:
250.2903
MDL Number:
MFCD00100663
IUPAC Name:
4-(4-butoxyphenyl)-4-oxobutanoic acid
InChI:
InChI=1S/C14H18O4/c1-2-3-10-18-12-6-4-11(5-7-12)13(15)8-9-14(16)17/h4-7H,2-3,8-10H2,1H3,(H,16,17)
InChI Key:
ONTSRRHNDXFIRG-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)C(=O)CCC(=O)O
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.121g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.294g/mol
Monoisotopic Mass:
250.121g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties