1,1'-Hexamethylenebis[3-(2-chloroethyl)-3-nitrosourea] (CAS 60784-45-4) — formula C12H22Cl2N6O4, molecular weight 385.24; category organic chemicals.
| CAS Number | 60784-45-4 |
|---|---|
| Molecular Formula | C12H22Cl2N6O4 |
| Molecular Weight | 385.24 |
| LogP | 1.6 |
| Category | Organic Chemicals |
1,1'-Hexamethylenebis[3-(2-chloroethyl)-3-nitrosourea] is a carbon-based organic compound with CAS registry number 60784-45-4 and molecular formula C12H22Cl2N6O4 (molecular weight 385.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 60784-45-4
Its molecular formula C12H22Cl2N6O4 comprises 12 C, 22 H, 2 Cl, 6 N, 4 O atoms.
Also known as: 1,1'-Hexamethylenebis[3-(2-chloroethyl)-3-nitrosourea] · 1,1'-六亚甲基双[3-(2-氯乙基)-3-亚硝基脲]
Category: organic chemicals
The CAS registry number of 1,1'-Hexamethylenebis[3-(2-chloroethyl)-3-nitrosourea] is 60784-45-4.
Molecular formula C12H22Cl2N6O4, molecular weight 385.24.
It is also registered under: 1,1'-Hexamethylenebis[3-(2-chloroethyl)-3-nitrosourea], 1,1'-六亚甲基双[3-(2-氯乙基)-3-亚硝基脲].
Category: Organic Chemicals.
Independent reference data for 1,1'-Hexamethylenebis[3-(2-chloroethyl)-3-nitrosourea] (CAS 60784-45-4), compiled from public chemistry databases.
| CAS 号 | 60784-45-4 |
|---|---|
| PubChem CID | 148901 |
| 分子式 | C12H22Cl2N6O4 |
| IUPAC 名称 | 1-(2-chloroethyl)-3-[6-[[2-chloroethyl(nitroso)carbamoyl]amino]hexyl]-1-nitrosourea |
| UNII（FDA） | DE65MHL27Z |
| Molecular Weight | 385.24 |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 11 |
| Exact Mass | 384.1079586 |
| Monoisotopic Mass | 384.1079586 |
| Topological Polar Surface Area | 124 |
| Heavy Atom Count | 24 |
60784-45-4; 1,1'-Hexamethylenebis-cnu; BRN 2022680; Urea, 1,1'-hexamethylenebis(3-(2-chloroethyl)-3-nitroso-; 1,1'-Hexamethylenebis(3-(2-chloroethyl)-3-nitrosourea); DTXSID70209609; 1,1'-Hexamethylenebis[3-(2-chloroethyl)-3-nitrosourea]; RefChem:387167; DTXCID70132100; DE65MHL27Z; Urea, N,N''-1,6-hexanediylbis[N'-(2-chloroethyl)-N'-nitroso-; DB-300849; N',N''-Hexane-1,6-diylbis[N-(2-chloroethyl)-N-nitrosourea]; HEXAMETHYLENEBIS(3-(2-CHLOROETHYL)-3-NITROSOUREA), 1,1'-
1,1'-六亚甲基双[3-(2-氯乙基)-3-亚硝基脲] · CAS 60784-45-4 · C12H22Cl2N6O4. UNII DE65MHL27Z.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.