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132335-44-5 | 2-Thiophenemethanol, α-[2-(dimethylamino)ethyl]-, (αS)-
CAS No: 132335-44-5 Catalog No: AG0010JU MDL No:MFCD07782107
Product Description
Catalog Number:
AG0010JU
Chemical Name:
2-Thiophenemethanol, α-[2-(dimethylamino)ethyl]-, (αS)-
CAS Number:
132335-44-5
Molecular Formula:
C9H15NOS
Molecular Weight:
185.2865
MDL Number:
MFCD07782107
IUPAC Name:
(1S)-3-(dimethylamino)-1-thiophen-2-ylpropan-1-ol
InChI:
InChI=1S/C9H15NOS/c1-10(2)6-5-8(11)9-4-3-7-12-9/h3-4,7-8,11H,5-6H2,1-2H3/t8-/m0/s1
InChI Key:
XWCNSHMHUZCRLN-QMMMGPOBSA-N
SMILES:
CN(CC[C@@H](c1cccs1)O)C
EC Number:
603-565-7
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
185.087g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.285g/mol
Monoisotopic Mass:
185.087g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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