Cas no 915707-49-2 (3-(4-methylperhydro-1,4-diazepin-1-yl)methylaniline)

3-(4-methylperhydro-1,4-diazepin-1-yl)methylaniline structure
915707-49-2 structure
Product Name:3-(4-methylperhydro-1,4-diazepin-1-yl)methylaniline
CAS No:915707-49-2
MF:C13H21N3
MW:219.325942754745
CID:996546
PubChem ID:24229555
Update Time:2025-04-20

3-(4-methylperhydro-1,4-diazepin-1-yl)methylaniline Chemical and Physical Properties

Names and Identifiers

    • 3-[(4-methyl-1,4-diazepan-1-yl)methyl]aniline
    • 3-[(4-Methylperhydro-1,4-diazepin-1-yl)methyl]aniline
    • 3-(4-methylperhydro-1,4-diazepin-1-yl)methylaniline
    • CS-0284169
    • DTXSID00640268
    • MS-22531
    • EN300-60652
    • 3-[(4-Methylperhydro-1,4-diazepin-1-yl)methyl]aniline,95%
    • SCHEMBL22538106
    • 3-((4-Methyl-1,4-diazepan-1-yl)methyl)aniline
    • 915707-49-2
    • Inchi: 1S/C13H21N3/c1-15-6-3-7-16(9-8-15)11-12-4-2-5-13(14)10-12/h2,4-5,10H,3,6-9,11,14H2,1H3
    • InChI Key: ZSOSQWJKEPUOCI-UHFFFAOYSA-N
    • SMILES: N1(CC2C=CC=C(C=2)N)CCN(C)CCC1

Computed Properties

  • Exact Mass: 219.17400
  • Monoisotopic Mass: 219.173547683g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 207
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.2
  • Topological Polar Surface Area: 32.5?2

Experimental Properties

  • PSA: 32.50000
  • LogP: 1.86330

3-(4-methylperhydro-1,4-diazepin-1-yl)methylaniline Security Information

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B489050-10mg
3-[(4-methylperhydro-1,4-diazepin-1-yl)methyl]aniline
915707-49-2
10mg
$ 50.00 2022-06-07
TRC
B489050-50mg
3-[(4-methylperhydro-1,4-diazepin-1-yl)methyl]aniline
915707-49-2
50mg
$ 70.00 2022-06-07
TRC
B489050-100mg
3-[(4-methylperhydro-1,4-diazepin-1-yl)methyl]aniline
915707-49-2
100mg
$ 115.00 2022-06-07
Enamine
EN300-60652-0.05g
3-[(4-methyl-1,4-diazepan-1-yl)methyl]aniline
915707-49-2
0.05g
$163.0 2023-06-01
Enamine
EN300-60652-0.1g
3-[(4-methyl-1,4-diazepan-1-yl)methyl]aniline
915707-49-2
0.1g
$171.0 2023-06-01
Enamine
EN300-60652-0.25g
3-[(4-methyl-1,4-diazepan-1-yl)methyl]aniline
915707-49-2
0.25g
$178.0 2023-06-01
Enamine
EN300-60652-0.5g
3-[(4-methyl-1,4-diazepan-1-yl)methyl]aniline
915707-49-2
0.5g
$187.0 2023-06-01
Enamine
EN300-60652-1.0g
3-[(4-methyl-1,4-diazepan-1-yl)methyl]aniline
915707-49-2
1g
$194.0 2023-06-01
Enamine
EN300-60652-2.5g
3-[(4-methyl-1,4-diazepan-1-yl)methyl]aniline
915707-49-2
2.5g
$408.0 2023-06-01
Enamine
EN300-60652-5.0g
3-[(4-methyl-1,4-diazepan-1-yl)methyl]aniline
915707-49-2
5g
$804.0 2023-06-01
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