TL;DR: 3-Chloro-4-methylbenzenecarboximidamide hydrochloride, AldrichCPR (CAS 116940-45-5) is a chemical compound with molecular formula C8H10Cl2N2 and molecular weight 204.02211 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-4-methylbenzenecarboximidamide;hydrochloride
Also Known As: 3-chloro-4-methyl-benzamidine;hydrochloride, 3-chloro-4-methylbenzenecarboximidamide hydrochloride, 3-chloro-4-methyl-benzenecarboximidamide Hydrochloride, 3-chloro-4-methylbenzene-1-carboximidamide hydrochloride, 3-Chloro-4-methylbenzenecarboximidamide hydrochloride, AldrichCPR
| Molecular Formula | C8H10Cl2N2 |
| Molecular Weight | 204.02211 g/mol |
| XLogP | 2.35429 |
| Topological Polar Surface Area (TPSA) | 49.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.02211 Da |
| Heavy Atoms | 12 |
| Complexity | 158.0 |
| SMILES | CC1=C(C=C(C=C1)C(=N)N)Cl.Cl |
| InChIKey | BNNCSOOYFACZLU-UHFFFAOYSA-N |
The XLogP value of 2.35429 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-4-methylbenzenecarboximidamide hydrochloride, AldrichCPR. With a topological polar surface area (TPSA) of 49.9 Ų, 3-Chloro-4-methylbenzenecarboximidamide hydrochloride, AldrichCPR exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-4-methylbenzenecarboximidamide hydrochloride, AldrichCPR has 3 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Chloro-4-methylbenzenecarboximidamide hydrochloride, AldrichCPR is 116940-45-5.
The molecular formula of 3-Chloro-4-methylbenzenecarboximidamide hydrochloride, AldrichCPR is C8H10Cl2N2.
The molecular weight of 3-Chloro-4-methylbenzenecarboximidamide hydrochloride, AldrichCPR is 204.02211 g/mol.
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