Home Other Building Blocks (1S,2S,3R,5S)-(+)-2,3-Pinanediol

(1S,2S,3R,5S)-(+)-2,3-Pinanediol

CAS No.:
18680-27-8
Catalog Number:
AG0037NG
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$23
- +
25g
95%
In Stock USA
United States
$72
- +
500g
98%
In Stock USA
United States
$975
- +
Product Description
Catalog Number:
AG0037NG
Chemical Name:
(1S,2S,3R,5S)-(+)-2,3-Pinanediol
CAS Number:
18680-27-8
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
MDL Number:
MFCD00077851
IUPAC Name:
(1S,2S,3R,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol
InChI:
InChI=1S/C10H18O2/c1-9(2)6-4-7(9)10(3,12)8(11)5-6/h6-8,11-12H,4-5H2,1-3H3/t6-,7-,8+,10-/m0/s1
InChI Key:
MOILFCKRQFQVFS-OORONAJNSA-N
SMILES:
O[C@@H]1C[C@@H]2C[C@H]([C@]1(C)O)C2(C)C
EC Number:
606-096-6
UNII:
Y6ZCV4AVRA
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
170.252g/mol
Monoisotopic Mass:
170.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties