| CAS Number | 1698-31-3 |
| Catalog Number | AG00AMCC(AGN-PC-0KHLM8) |
| Chemical Name | 4-(diphenylmethyl)piperazin-1-amine |
| IUPAC Name | 4-benzhydrylpiperazin-1-amine |
| InChI | InChI=1S/C17H21N3/c18-20-13-11-19(12-14-20)17(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,17H,11-14,18H2 |
| InChI Key | QEMWWFHROBPSSM-UHFFFAOYSA-N |
| MDL Number | MFCD02271428 |
| Molecular Formula | C17H21N3 |
| Molecular Weight | 267.3687 |
| SMILES | NN1CCN(C(C2=CC=CC=C2)C2=CC=CC=C2)CC1 |
| Synonyms | 4-Benzhydryl-piperazin-1-ylamine,
1698-31-3,
4-(diphenylmethyl)piperazin-1-amine,
4-benzhydrylpiperazin-1-amine,
AC1M91BZ,
AC1Q54QY,
SCHEMBL5624207,
4-Benzhydrylpiperazin-1-ylamine,
CTK4D3414,
DTXSID40368878,
4-(diphenylmethyl)piperazinylamine,
SBB040707,
ZINC95351769,
1-Piperazinamine,4-(diphenylmethyl)-,
AKOS000122436,
MCULE-3248069497,
NE39343,
EN300-06694,
Z57035346,
CID2524923,
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| Complexity | 256 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.174g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.376g/mol |
| Monoisotopic Mass | 267.174g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number