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114362-20-8 | 4-Pyrimidinamine, 2-(1,1-dimethylethyl)-
CAS No: 114362-20-8 Catalog No: AG000B5M MDL No:MFCD01646228
Product Description
Catalog Number:
AG000B5M
Chemical Name:
4-Pyrimidinamine, 2-(1,1-dimethylethyl)-
CAS Number:
114362-20-8
Molecular Formula:
C8H13N3
Molecular Weight:
151.2089
MDL Number:
MFCD01646228
IUPAC Name:
2-tert-butylpyrimidin-4-amine
InChI:
InChI=1S/C8H13N3/c1-8(2,3)7-10-5-4-6(9)11-7/h4-5H,1-3H3,(H2,9,10,11)
InChI Key:
RRFVDJXZQAAJFH-UHFFFAOYSA-N
SMILES:
CC(c1nccc(n1)N)(C)C
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.111g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.213g/mol
Monoisotopic Mass:
151.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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