AG003Q7K

1123725-69-8 | Ethyl 3-cyclopropyl-1H-pyrrole-2-carboxylate

AG003Q7K

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CAS Number	1123725-69-8
Catalog Number	AG003Q7K(AGN-PC-04XPZS)
Chemical Name	Ethyl 3-cyclopropyl-1H-pyrrole-2-carboxylate
IUPAC Name	ethyl 3-cyclopropyl-1H-pyrrole-2-carboxylate
InChI	InChI=1S/C10H13NO2/c1-2-13-10(12)9-8(5-6-11-9)7-3-4-7/h5-7,11H,2-4H2,1H3
InChI Key	ROKRDQDLLBXZRX-UHFFFAOYSA-N
MDL Number	MFCD12924310
Molecular Formula	C10H13NO2
Molecular Weight	179.2157
SMILES	O=C(C1=C(C2CC2)C=CN1)OCC
Synonyms	1123725-69-8, Ethyl 3-Cyclopropylpyrrole-2-carboxylate, Ethyl 3-cyclopropyl-1H-pyrrole-2-carboxylate, 3-Cyclopropyl-1H-pyrrole-2-carboxylic acid ethyl ester, SCHEMBL15559031, ROKRDQDLLBXZRX-UHFFFAOYSA-N, KS-00000BN6, 6737AJ, MFCD12924310, ZINC59051794, AKOS017515427, TRA-0195133, AS-32125, DA-16955, SY018205, AJ-113227, TC-308246, FT-0733724, ETHYL3-CYCLOPROPYLPYRROLE-2-CARBOXYLATE, Z-4432, MFCD12924310 (95+%), C10H13NO2, 55289-35-5,

Complexity	201
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.095g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	179.219g/mol
Monoisotopic Mass	179.095g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	42.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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