Home Other Building Blocks (2S,4S)-(+)-Pentanediol

(2S,4S)-(+)-Pentanediol

CAS No.:
72345-23-4
Catalog Number:
AG003BPK
Molecular Formula:
C5H12O2
Molecular Weight:
104.1476
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$125
- +
5g
98%
In Stock USA
United States
$500
- +
10g
98%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG003BPK
Chemical Name:
(2S,4S)-(+)-Pentanediol
CAS Number:
72345-23-4
Molecular Formula:
C5H12O2
Molecular Weight:
104.1476
MDL Number:
MFCD00064276
IUPAC Name:
(2S,4S)-pentane-2,4-diol
InChI:
InChI=1S/C5H12O2/c1-4(6)3-5(2)7/h4-7H,3H2,1-2H3/t4-,5-/m0/s1
InChI Key:
GTCCGKPBSJZVRZ-WHFBIAKZSA-N
SMILES:
C[C@@H](C[C@@H](O)C)O
UNII:
6DM2071X2E
Properties
Complexity:
39.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
104.084g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
104.149g/mol
Monoisotopic Mass:
104.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties