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885268-83-7 | Carbamic acid,[3-(hydroxymethyl)-3-piperidinyl]-, 1,1-dimethylethyl ester (9CI)
CAS No: 885268-83-7 Catalog No: AG00486M MDL No:MFCD08234492
Product Description
Catalog Number:
AG00486M
Chemical Name:
Carbamic acid,[3-(hydroxymethyl)-3-piperidinyl]-, 1,1-dimethylethyl ester (9CI)
CAS Number:
885268-83-7
Molecular Formula:
C11H22N2O3
Molecular Weight:
230.3040
MDL Number:
MFCD08234492
IUPAC Name:
tert-butyl N-[3-(hydroxymethyl)piperidin-3-yl]carbamate
InChI:
InChI=1S/C11H22N2O3/c1-10(2,3)16-9(15)13-11(8-14)5-4-6-12-7-11/h12,14H,4-8H2,1-3H3,(H,13,15)
InChI Key:
DQUMGUGHUCDTDY-UHFFFAOYSA-N
SMILES:
OCC1(CCCNC1)NC(=O)OC(C)(C)C
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.163g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
230.308g/mol
Monoisotopic Mass:
230.163g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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