| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2005 | 9 | Yes |
Popular Name: 3-aminoazepan-2-one 3-aminoazepan-2-one
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17929-90-7 , 21568-87-6 , 26081-07-2 , 29426-64-0 , 671-42-1 , [21568-87-6] , [26081-07-2] , [29426-64-0] , [671-42-1]
(+/-)-alpha-Amino-omega-caprolactam
(R/S)-a-Amino-omega-caprolactam
(R/S)-alpha-Amino-omega-caprolactam
(R/S)-Ä-Amino-omega-caprolactam
(S)-3-Amino-2-oxo-azepane hydrochloride
(S)-3-AMINO-HEXAHYDRO-2-AZEPINONE
(S)-3-amino-hexahydro-2-azepinone hydrochloride
(S)-3-Aminoazepan-2-one hydrochloride
(S)-3-Aminoazepan-2-onehydrochloride
(S)-α-Amino-omega-caprolactam
2H-Azepin-2-one, 3-aminohexahydro-
2H-Azepin-2-one,3-aminohexahydro-
3-Aminoazepan-2-one hydrochloride
3-Aminohexahydro-2H-azepin-2-one hydrochloride
3-aminohexahydro-2H-azepin-2-one; alpha-amino-epsilon-caprolactam
C02837; L-2-Amino-hexano-6-lactam; L-Lysine 1,6-lactam; L-alpha-Aminocaprolactam
CHEBI:29078; CHEBI:13136; CHEBI:6160; CHEBI:21352; CHEBI:13054; CHEBI:6265; CHEBI:21202
DL-α-Amino-ε-caprolactamhydrochloride
DL-ALPHA-AMINO-EPSILON-CAPROLACTAM
Dl-alpha-amino-epsilon-caprolactam HCl
DL-alpha-Amino-epsilon-caprolactam Hydrochloride
L-(-)alpha-amino-epsilon-caprolactam
L-2-amino-hexano-6-lactam; L-lysine 1,6-lactam
L-2-aminohexano-6-lactam; L-2-ammoniohexano-6-lactam(1+)
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -0.81 | -0.76 | -46.32 | 4 | 3 | 1 | 57 | 129.183 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 168-172°/13 Torr | Matrix Scientific |
| BP | 172 / 13 | TCI |
| MP | 294 | TCI |
| MP | 54 - 56 | Enamine Building Blocks |
| MP | 54...56 | Enamine Building Blocks |
| MP | 58 - 60 | Enamine Building Blocks |
| MP | 68-69° | Matrix Scientific |
| MP | 77 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 96% | Fluorochem |
| Purity | 98% | APIChem |
| Purity | 99% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
| Patent Database Links | US2005020659 | ChEBI |
No pre-computed analogs available. Try a structural similarity search.