Home Other Building Blocks 4-Ethoxy-4-isopropylmethylcyclohex-1-ene

4-Ethoxy-4-isopropylmethylcyclohex-1-ene

CAS No.:
54982-76-2
Catalog Number:
AG003ATQ
Molecular Formula:
C12H22O
Molecular Weight:
182.3025
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Product Description
Catalog Number:
AG003ATQ
Chemical Name:
4-Ethoxy-4-isopropylmethylcyclohex-1-ene
CAS Number:
54982-76-2
Molecular Formula:
C12H22O
Molecular Weight:
182.3025
MDL Number:
MFCD18971736
IUPAC Name:
4-ethoxy-1-methyl-4-propan-2-ylcyclohexene
InChI:
InChI=1S/C12H22O/c1-5-13-12(10(2)3)8-6-11(4)7-9-12/h6,10H,5,7-9H2,1-4H3
InChI Key:
RRBKCTRIOFQEIN-UHFFFAOYSA-N
SMILES:
CCOC1(CCC(=CC1)C)C(C)C
EC Number:
259-422-0
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.167g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.307g/mol
Monoisotopic Mass:
182.167g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties