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1248203-41-9 | 2-(Isopropyl-thiophen-3-ylmethyl-amino)-ethanol
CAS No: 1248203-41-9 Catalog No: AG01F9RU MDL No:
Product Description
Catalog Number:
AG01F9RU
Chemical Name:
2-(Isopropyl-thiophen-3-ylmethyl-amino)-ethanol
CAS Number:
1248203-41-9
Molecular Formula:
C10H17NOS
Molecular Weight:
199.3131
IUPAC Name:
2-[propan-2-yl(thiophen-3-ylmethyl)amino]ethanol
InChI:
InChI=1S/C10H17NOS/c1-9(2)11(4-5-12)7-10-3-6-13-8-10/h3,6,8-9,12H,4-5,7H2,1-2H3
InChI Key:
SRELJMCAGWHKBO-UHFFFAOYSA-N
SMILES:
OCCN(C(C)C)Cc1cscc1
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.103g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.312g/mol
Monoisotopic Mass:
199.103g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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