Ethyl 5-Bromopyrrole-2-carboxylate - CAS 740813-37-0
Catalog: |
BB034981 |
Product Name: |
Ethyl 5-Bromopyrrole-2-carboxylate |
CAS: |
740813-37-0 |
Synonyms: |
5-bromo-1H-pyrrole-2-carboxylic acid ethyl ester; ethyl 5-bromo-1H-pyrrole-2-carboxylate |
IUPAC Name: | ethyl 5-bromo-1H-pyrrole-2-carboxylate |
Description: | Ethyl 5-Bromopyrrole-2-carboxylate (CAS# 740813-37-0) is a useful research chemical. |
Molecular Weight: | 218.05 |
Molecular Formula: | C7H8BrNO2 |
Canonical SMILES: | CCOC(=O)C1=CC=C(N1)Br |
InChI: | InChI=1S/C7H8BrNO2/c1-2-11-7(10)5-3-4-6(8)9-5/h3-4,9H,2H2,1H3 |
InChI Key: | MAWSPHLRAHWQKY-UHFFFAOYSA-N |
LogP: | 1.95390 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-10695334-B2 | Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors | 20180816 |
US-2020054617-A1 | Heteroaromatic Carboxamide Derivatives as Plasma Kallikrein Inhibitors | 20180816 |
WO-2020035540-A1 | Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors | 20180816 |
TW-202021586-A | Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors | 20180816 |
CN-113039181-A | Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors | 20180816 |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 216.97384 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 216.97384 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 42.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS