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137-17-7 | Benzenamine, 2,4,5-trimethyl-
CAS No: 137-17-7 Catalog No: AG0012OH MDL No:MFCD00025201
Product Description
Catalog Number:
AG0012OH
Chemical Name:
Benzenamine, 2,4,5-trimethyl-
CAS Number:
137-17-7
Molecular Formula:
C9H13N
Molecular Weight:
135.2062
MDL Number:
MFCD00025201
IUPAC Name:
2,4,5-trimethylaniline
InChI:
InChI=1S/C9H13N/c1-6-4-8(3)9(10)5-7(6)2/h4-5H,10H2,1-3H3
InChI Key:
BMIPMKQAAJKBKP-UHFFFAOYSA-N
SMILES:
Cc1cc(N)c(cc1C)C
EC Number:
205-282-0
UNII:
00KUO98F97
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.105g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.21g/mol
Monoisotopic Mass:
135.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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