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139755-70-7 | 1,2-Propanediol, 3-(3-aminopropoxy)-
CAS No: 139755-70-7 Catalog No: AG001BO6 MDL No:
Product Description
Catalog Number:
AG001BO6
Chemical Name:
1,2-Propanediol, 3-(3-aminopropoxy)-
CAS Number:
139755-70-7
Molecular Formula:
C6H15NO3
Molecular Weight:
149.1882
IUPAC Name:
3-(3-aminopropoxy)propane-1,2-diol
InChI:
InChI=1S/C6H15NO3/c7-2-1-3-10-5-6(9)4-8/h6,8-9H,1-5,7H2
InChI Key:
LCTPWIYQTIJTQU-UHFFFAOYSA-N
SMILES:
NCCCOCC(CO)O
Properties
Complexity:
70
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.105g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
149.19g/mol
Monoisotopic Mass:
149.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
75.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8
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