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10250-27-8 | 1-Propanol, 2-methyl-2-[(phenylmethyl)amino]-
CAS No: 10250-27-8 Catalog No: AG0007LL MDL No:MFCD04500950
Product Description
Catalog Number:
AG0007LL
Chemical Name:
1-Propanol, 2-methyl-2-[(phenylmethyl)amino]-
CAS Number:
10250-27-8
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
MDL Number:
MFCD04500950
IUPAC Name:
2-(benzylamino)-2-methylpropan-1-ol
InChI:
InChI=1S/C11H17NO/c1-11(2,9-13)12-8-10-6-4-3-5-7-10/h3-7,12-13H,8-9H2,1-2H3
InChI Key:
JIDHEIXSIHNMCG-UHFFFAOYSA-N
SMILES:
OCC(NCc1ccccc1)(C)C
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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