Cas no 789457-36-9 (Benzeneacetic acid, 4-(3-aminopropyl)-, methyl ester)
789457-36-9 structure
Product Name:Benzeneacetic acid, 4-(3-aminopropyl)-, methyl ester
CAS No:789457-36-9
MF:C12H17NO2
MW:207.268883466721
CID:4188181
PubChem ID:20083726
Update Time:2025-04-24
Benzeneacetic acid, 4-(3-aminopropyl)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetic acid, 4-(3-aminopropyl)-, methyl ester
- methyl 2-[4-(3-aminopropyl)phenyl]acetate
- SCHEMBL5843409
- 789457-36-9
- EN300-7529869
-
- Inchi： 1S/C12H17NO2/c1-15-12(14)9-11-6-4-10(5-7-11)3-2-8-13/h4-7H,2-3,8-9,13H2,1H3
- InChI Key： XKTLNGGTCBOBFD-UHFFFAOYSA-N
- SMILES： O(C)C(CC1C=CC(=CC=1)CCCN)=O
Computed Properties
- Exact Mass: 207.125928785Da
- Monoisotopic Mass: 207.125928785Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 186
- 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: 1.5
- Topological Polar Surface Area: 52.3?2
Benzeneacetic acid, 4-(3-aminopropyl)-, methyl ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-7529869-0.05g |
methyl 2-[4-(3-aminopropyl)phenyl]acetate |
789457-36-9 | 95% | 0.05g |
$912.0 | 2024-05-23 | |
| Enamine | EN300-7529869-0.1g |
methyl 2-[4-(3-aminopropyl)phenyl]acetate |
789457-36-9 | 95% | 0.1g |
$956.0 | 2024-05-23 | |
| Enamine | EN300-7529869-0.25g |
methyl 2-[4-(3-aminopropyl)phenyl]acetate |
789457-36-9 | 95% | 0.25g |
$999.0 | 2024-05-23 | |
| Enamine | EN300-7529869-0.5g |
methyl 2-[4-(3-aminopropyl)phenyl]acetate |
789457-36-9 | 95% | 0.5g |
$1043.0 | 2024-05-23 | |
| Enamine | EN300-7529869-1.0g |
methyl 2-[4-(3-aminopropyl)phenyl]acetate |
789457-36-9 | 95% | 1.0g |
$1086.0 | 2024-05-23 | |
| Enamine | EN300-7529869-2.5g |
methyl 2-[4-(3-aminopropyl)phenyl]acetate |
789457-36-9 | 95% | 2.5g |
$2127.0 | 2024-05-23 | |
| Enamine | EN300-7529869-5.0g |
methyl 2-[4-(3-aminopropyl)phenyl]acetate |
789457-36-9 | 95% | 5.0g |
$3147.0 | 2024-05-23 | |
| Enamine | EN300-7529869-10.0g |
methyl 2-[4-(3-aminopropyl)phenyl]acetate |
789457-36-9 | 95% | 10.0g |
$4667.0 | 2024-05-23 |
Benzeneacetic acid, 4-(3-aminopropyl)-, methyl ester Related Literature
-
Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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