Home Other Building Blocks 2-(3,4-DIMETHYLCYCLOHEXYL)ACETIC ACID

2-(3,4-DIMETHYLCYCLOHEXYL)ACETIC ACID

CAS No.:
85120-34-9
Catalog Number:
AG01DQXN
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
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Product Description
Catalog Number:
AG01DQXN
Chemical Name:
2-(3,4-DIMETHYLCYCLOHEXYL)ACETIC ACID
CAS Number:
85120-34-9
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
MDL Number:
MFCD20405801
IUPAC Name:
2-(3,4-dimethylcyclohexyl)acetic acid
InChI:
InChI=1S/C10H18O2/c1-7-3-4-9(5-8(7)2)6-10(11)12/h7-9H,3-6H2,1-2H3,(H,11,12)
InChI Key:
NDLNYVBNKQVKIM-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCC(C(C1)C)C
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.131g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.252g/mol
Monoisotopic Mass:
170.131g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties