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1159823-00-3 | Carbamic acid, N-3-piperidinyl-, 1,1-dimethylethyl ester, hydrochloride (1:1)
CAS No: 1159823-00-3 Catalog No: AG000HB1 MDL No:MFCD06796185
Product Description
Catalog Number:
AG000HB1
Chemical Name:
Carbamic acid, N-3-piperidinyl-, 1,1-dimethylethyl ester, hydrochloride (1:1)
CAS Number:
1159823-00-3
Molecular Formula:
C10H21ClN2O2
Molecular Weight:
236.7389
MDL Number:
MFCD06796185
IUPAC Name:
tert-butyl N-piperidin-3-ylcarbamate;hydrochloride
InChI:
InChI=1S/C10H20N2O2.ClH/c1-10(2,3)14-9(13)12-8-5-4-6-11-7-8;/h8,11H,4-7H2,1-3H3,(H,12,13);1H
InChI Key:
FQJZJMFUNRMGTA-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCCNC1.Cl
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.129g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
236.74g/mol
Monoisotopic Mass:
236.129g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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