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893615-23-1 | 2-METHYL-2-[(3-PYRIDINYLMETHYL)AMINO]-1-PROPANOL
CAS No: 893615-23-1 Catalog No: AG003XPU MDL No:MFCD04573186
Product Description
Catalog Number:
AG003XPU
Chemical Name:
2-METHYL-2-[(3-PYRIDINYLMETHYL)AMINO]-1-PROPANOL
CAS Number:
893615-23-1
Molecular Formula:
C10H16N2O
Molecular Weight:
180.2468
MDL Number:
MFCD04573186
IUPAC Name:
2-methyl-2-(pyridin-3-ylmethylamino)propan-1-ol
InChI:
InChI=1S/C10H16N2O/c1-10(2,8-13)12-7-9-4-3-5-11-6-9/h3-6,12-13H,7-8H2,1-2H3
InChI Key:
ZYKZTDZNOFYWTF-UHFFFAOYSA-N
SMILES:
OCC(NCc1cccnc1)(C)C
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.251g/mol
Monoisotopic Mass:
180.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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