Home Other Building Blocks 1-ETHYL-1-METHYLSUCCINIC ACID

1-ETHYL-1-METHYLSUCCINIC ACID

CAS No.:
631-31-2
Catalog Number:
AG00EAYK
Molecular Formula:
C7H12O4
Molecular Weight:
160.1678
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00EAYK
Chemical Name:
1-ETHYL-1-METHYLSUCCINIC ACID
CAS Number:
631-31-2
Molecular Formula:
C7H12O4
Molecular Weight:
160.1678
MDL Number:
MFCD00004201
IUPAC Name:
2-ethyl-2-methylbutanedioic acid
InChI:
InChI=1S/C7H12O4/c1-3-7(2,6(10)11)4-5(8)9/h3-4H2,1-2H3,(H,8,9)(H,10,11)
InChI Key:
FDYJJKHDNNVUDR-UHFFFAOYSA-N
SMILES:
CCC(C(=O)O)(CC(=O)O)C
EC Number:
211-154-5
NSC Number:
38752
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.074g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
160.169g/mol
Monoisotopic Mass:
160.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties