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893615-89-9 | 2-METHYL-2-{[(5-METHYL-2-THIENYL)METHYL]AMINO}-1-PROPANOL
CAS No: 893615-89-9 Catalog No: AG003YWS MDL No:MFCD04583908
Product Description
Catalog Number:
AG003YWS
Chemical Name:
2-METHYL-2-{[(5-METHYL-2-THIENYL)METHYL]AMINO}-1-PROPANOL
CAS Number:
893615-89-9
Molecular Formula:
C10H17NOS
Molecular Weight:
199.3131
MDL Number:
MFCD04583908
IUPAC Name:
2-methyl-2-[(5-methylthiophen-2-yl)methylamino]propan-1-ol
InChI:
InChI=1S/C10H17NOS/c1-8-4-5-9(13-8)6-11-10(2,3)7-12/h4-5,11-12H,6-7H2,1-3H3
InChI Key:
OFSXVWYVDKFVSA-UHFFFAOYSA-N
SMILES:
OCC(NCc1ccc(s1)C)(C)C
Properties
Complexity:
161
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:
2
Isotope Atom Count:
0
Molecular Weight:
199.312g/mol
Monoisotopic Mass:
199.103g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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