Home Other Building Blocks 2-[(1S)-cyclohex-3-en-1-yl]acetic acid

2-[(1S)-cyclohex-3-en-1-yl]acetic acid

CAS No.:
67976-84-5
Catalog Number:
AG01EM09
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
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Product Description
Catalog Number:
AG01EM09
Chemical Name:
2-[(1S)-cyclohex-3-en-1-yl]acetic acid
CAS Number:
67976-84-5
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
MDL Number:
MFCD19231177
IUPAC Name:
2-[(1S)-cyclohex-3-en-1-yl]acetic acid
InChI:
InChI=1S/C8H12O2/c9-8(10)6-7-4-2-1-3-5-7/h1-2,7H,3-6H2,(H,9,10)/t7-/m1/s1
InChI Key:
ZSSAXGUMEUVSOC-SSDOTTSWSA-N
SMILES:
OC(=O)C[C@H]1CCC=CC1
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
140.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.182g/mol
Monoisotopic Mass:
140.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties