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137788-49-9 | 1-Propanol, 3-[(1-methylpropyl)amino]-
CAS No: 137788-49-9 Catalog No: AG0013UU MDL No:
Product Description
Catalog Number:
AG0013UU
Chemical Name:
1-Propanol, 3-[(1-methylpropyl)amino]-
CAS Number:
137788-49-9
Molecular Formula:
C7H17NO
Molecular Weight:
131.2160
IUPAC Name:
3-(butan-2-ylamino)propan-1-ol
InChI:
InChI=1S/C7H17NO/c1-3-7(2)8-5-4-6-9/h7-9H,3-6H2,1-2H3
InChI Key:
VMPRBERBKMHSKG-UHFFFAOYSA-N
SMILES:
OCCCNC(CC)C
Properties
Complexity:
56.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.131g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
131.219g/mol
Monoisotopic Mass:
131.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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