Cas no 31970-04-4 (Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate)
31970-04-4 structure
Product Name:Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate
CAS No:31970-04-4
MF:C12H13NO2
MW:203.237123250961
MDL:MFCD01863559
CID:53823
PubChem ID:24872878
Update Time:2025-04-18
Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate
- Benzyl 3-pyrroline-1-carboxylate
- 2,5-Dihydropyrrole-1-carboxylic acid benzyl ester
- N-Carbobenzoxy-3-pyrroline
- 1-Cbz-2,5-dihydro-1H-pyrrole
- benzyl 2,5-dihydropyrrole-1-carboxylate
- N-Cbz-3-pyrroline
- benzyl 3,4-didehydropyrrolidine-1-carboxylate
- Benzyl 3-Pyrroline-1-Carboxylate 90
- N-Cbz-2,5-dihydropyrrole
- N-Benzyloxycarbonyl-3-pyrroline
- BP-12381
- Benzyl-3-pyrrolidine1-carboxylate
- SCHEMBL92054
- FS-3352
- C2872
- FT-0655594
- AC-28114
- N-(BENZYLOXYCARBONYL)-3-PYRROLINE
- DTXSID60349189
- 1-benzyloxycarbonyl-3-pyrroline
- ?BENZYL 3-PYRROLINE-1-CARBOXYLATE 90
- 2,5-Dihydro-pyrrole-1-carboxylic acid benzyl ester
- InChI=1/C12H13NO2/c14-12(13-8-4-5-9-13)15-10-11-6-2-1-3-7-11/h1-7H,8-10H
- Benzyl-3-pyrroline-1-carboxylate
- 3-Pyrroline-1-carboxylic acid benzyl ester
- XSKKIFJNZPNVGO-UHFFFAOYSA-N
- benzyl 2,5-dihydropyrrole-1-carboxylate;Benzyl 3-pyrroline-1-carboxylate
- MFCD01863559
- Benzyl-2,5-dihydro-1H-pyrrole-1-carboxylate
- 31970-04-4
- AKOS015919424
- SY021710
- BCP31023
- AMY6776
- EN300-115676
- Benzyl 3-pyrroline-1-carboxylate, 90%
- 1H-pyrrole-1-carboxylic acid, 2,5-dihydro-, phenylmethyl ester
- J-018580
- PB18547
- Benzyl 2H-pyrrole-1(5H)-carboxylate
- phenylmethyl 2,5-dihydro-1H-pyrrole-1-carboxylate
- CS-W002856
- AKOS025243427
- A821080
- DB-068559
- 2,5-Dihydropyrrole-1-Cbz
-
- MDL： MFCD01863559
- Inchi： 1S/C12H13NO2/c14-12(13-8-4-5-9-13)15-10-11-6-2-1-3-7-11/h1-7H,8-10H2
- InChI Key： XSKKIFJNZPNVGO-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C(N1CC=CC1)=O
Computed Properties
- Exact Mass: 203.09500
- Monoisotopic Mass: 203.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 236
- 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
- Topological Polar Surface Area: 29.5A^2
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 1.9
Experimental Properties
- Color/Form: Colorless to Yellow Liquid
- Density: 1.132?g/mL?at 25?°C(lit.)
- Melting Point: No data available
- Boiling Point: 126°C/0.32mmHg(lit.)
- Flash Point: >230?°F
- Refractive Index: n20/D 1.544(lit.)
- PSA: 29.54000
- LogP: 2.13290
- Solubility: Not determined
Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate Security Information
-
Symbol:
- Prompt：warning
- Signal Word：Warning
- Hazard Statement： H315,H319,H335
- Warning Statement： P261,P305+P351+P338
- Hazardous Material transportation number：NONH for all modes of transport
- WGK Germany：3
- Hazard Category Code： 36/37/38
- Safety Instruction： S26-S36
-
Hazardous Material Identification：
- Risk Phrases：R36/37/38
- Storage Condition：Inert atmosphere,2-8°C
- Safety Term：S26;S36
Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate Customs Data
- HS CODE：2933990090
- Customs Data：
China Customs Code:
2933990090Overview:
2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
Summary:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 092447-1g |
1-Cbz-2,5-dihydro-1H-pyrrole |
31970-04-4 | 95% | 1g |
￡10.00 | 2022-02-28 | |
| Fluorochem | 092447-5g |
1-Cbz-2,5-dihydro-1H-pyrrole |
31970-04-4 | 95% | 5g |
￡22.00 | 2022-02-28 | |
| Chemenu | CM107770-100g |
benzyl 2,5-dihydropyrrole-1-carboxylate |
31970-04-4 | 95+% | 100g |
$750 | 2021-08-06 | |
| AstaTech | 51080-5/G |
1-CBZ-2,5-DIHYDRO-1H-PYRROLE |
31970-04-4 | 97% | 5g |
$33 | 2023-09-17 | |
| AstaTech | 51080-25/G |
1-CBZ-2,5-DIHYDRO-1H-PYRROLE |
31970-04-4 | 97% | 25g |
$90 | 2023-09-17 | |
| AstaTech | 51080-100/G |
1-CBZ-2,5-DIHYDRO-1H-PYRROLE |
31970-04-4 | 97% | 100g |
$310 | 2023-09-17 | |
| Ambeed | A149172-1g |
Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate |
31970-04-4 | 97% | 1g |
$12.0 | 2025-02-26 | |
| Ambeed | A149172-5g |
Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate |
31970-04-4 | 97% | 5g |
$16.0 | 2025-02-26 | |
| Ambeed | A149172-10g |
Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate |
31970-04-4 | 97% | 10g |
$20.0 | 2025-02-26 | |
| Ambeed | A149172-25g |
Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate |
31970-04-4 | 97% | 25g |
$49.0 | 2025-02-26 |
Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate Related Literature
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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