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132710-90-8 | 1-Piperazinecarboxylic acid, 4-(3-hydroxypropyl)-, 1,1-dimethylethyl ester
CAS No: 132710-90-8 Catalog No: AG00111T MDL No:MFCD06798090
Product Description
Catalog Number:
AG00111T
Chemical Name:
1-Piperazinecarboxylic acid, 4-(3-hydroxypropyl)-, 1,1-dimethylethyl ester
CAS Number:
132710-90-8
Molecular Formula:
C12H24N2O3
Molecular Weight:
244.3306
MDL Number:
MFCD06798090
IUPAC Name:
tert-butyl 4-(3-hydroxypropyl)piperazine-1-carboxylate
InChI:
InChI=1S/C12H24N2O3/c1-12(2,3)17-11(16)14-8-6-13(7-9-14)5-4-10-15/h15H,4-10H2,1-3H3
InChI Key:
LRYRQGKGCIUVON-UHFFFAOYSA-N
SMILES:
OCCCN1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.179g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.335g/mol
Monoisotopic Mass:
244.179g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
53A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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