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101857-37-8 | 1,2-Propanediamine, 3-methoxy-
CAS No: 101857-37-8 Catalog No: AG0005R3 MDL No:MFCD19204176
Product Description
Catalog Number:
AG0005R3
Chemical Name:
1,2-Propanediamine, 3-methoxy-
CAS Number:
101857-37-8
Molecular Formula:
C4H12N2O
Molecular Weight:
104.1509
MDL Number:
MFCD19204176
IUPAC Name:
3-methoxypropane-1,2-diamine
InChI:
InChI=1S/C4H12N2O/c1-7-3-4(6)2-5/h4H,2-3,5-6H2,1H3
InChI Key:
LNPOMYDQIBCEEO-UHFFFAOYSA-N
SMILES:
COCC(CN)N
Properties
Complexity:
40.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
104.095g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
104.153g/mol
Monoisotopic Mass:
104.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7
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