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1904-16-1 | 1-Pyrrolidinepropanol, 2,5-dimethyl-
CAS No: 1904-16-1 Catalog No: AG002EJB MDL No:
Product Description
Catalog Number:
AG002EJB
Chemical Name:
1-Pyrrolidinepropanol, 2,5-dimethyl-
CAS Number:
1904-16-1
Molecular Formula:
C9H19NO
Molecular Weight:
157.2533
IUPAC Name:
3-(2,5-dimethylpyrrolidin-1-yl)propan-1-ol
InChI:
InChI=1S/C9H19NO/c1-8-4-5-9(2)10(8)6-3-7-11/h8-9,11H,3-7H2,1-2H3
InChI Key:
NAXTXBAUPVGPMV-UHFFFAOYSA-N
SMILES:
OCCCN1C(C)CCC1C
EC Number:
217-603-1
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.147g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.257g/mol
Monoisotopic Mass:
157.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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