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721958-87-8 | Ethanol, 2-[[(5-methyl-2-thienyl)methyl]amino]-
CAS No: 721958-87-8 Catalog No: AG005JG9 MDL No:MFCD04570809
Product Description
Catalog Number:
AG005JG9
Chemical Name:
Ethanol, 2-[[(5-methyl-2-thienyl)methyl]amino]-
CAS Number:
721958-87-8
Molecular Formula:
C8H13NOS
Molecular Weight:
171.2599
MDL Number:
MFCD04570809
IUPAC Name:
2-[(5-methylthiophen-2-yl)methylamino]ethanol
InChI:
InChI=1S/C8H13NOS/c1-7-2-3-8(11-7)6-9-4-5-10/h2-3,9-10H,4-6H2,1H3
InChI Key:
CPRWEWWOBOJKMQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)CNCCO
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.072g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
171.258g/mol
Monoisotopic Mass:
171.072g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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