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1201937-24-7 | (2-Hydroxy-ethyl)-(1,2,3,4-tetrahydro-quinolin-2-ylmethyl)-carbamic acid tert-butyl ester
CAS No: 1201937-24-7 Catalog No: AG00JPAK MDL No:
Product Description
Catalog Number:
AG00JPAK
Chemical Name:
(2-Hydroxy-ethyl)-(1,2,3,4-tetrahydro-quinolin-2-ylmethyl)-carbamic acid tert-butyl ester
CAS Number:
1201937-24-7
Molecular Formula:
C17H26N2O3
Molecular Weight:
306.3999
IUPAC Name:
tert-butyl N-(2-hydroxyethyl)-N-(1,2,3,4-tetrahydroquinolin-2-ylmethyl)carbamate
InChI:
InChI=1S/C17H26N2O3/c1-17(2,3)22-16(21)19(10-11-20)12-14-9-8-13-6-4-5-7-15(13)18-14/h4-7,14,18,20H,8-12H2,1-3H3
InChI Key:
KCZSIJXEBCOSBT-UHFFFAOYSA-N
SMILES:
OCCN(C(=O)OC(C)(C)C)CC1CCc2c(N1)cccc2
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.194g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
306.406g/mol
Monoisotopic Mass:
306.194g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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