AG00EBQD

618-30-4 | 5-Chlorofuran-2-carboxylic acid

AG00EBQD

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CAS Number	618-30-4
Catalog Number	AG00EBQD(AGN-PC-09RD6S)
Chemical Name	5-Chlorofuran-2-carboxylic acid
IUPAC Name	5-chlorofuran-2-carboxylic acid
InChI	InChI=1S/C5H3ClO3/c6-4-2-1-3(9-4)5(7)8/h1-2H,(H,7,8)
InChI Key	NNTBDUTXMIMRKK-UHFFFAOYSA-N
MDL Number	MFCD00093272
Molecular Formula	C5H3ClO3
Molecular Weight	146.5285
NSC Number	35572
SMILES	O=C(C1=CC=C(Cl)O1)O
Synonyms	5-chlorofuran-2-carboxylic acid, 618-30-4, 5-chloro-2-furoic acid, 2-Furancarboxylic acid, 5-chloro-, 2-Furoic acid, 5-chloro-, 5-chloro-2-furancarboxylic acid, NSC35572, 5-chloro-2furoic acid, AC1Q5UHQ, C5H3ClO3, ACMC-1B6JU, AC1L5T3T, KSC493E7H, SCHEMBL584719, AC1Q738V, CTK3J3273, DTXSID10284096, NNTBDUTXMIMRKK-UHFFFAOYSA-N, ZINC400042, BCP21554, KS-00000F3Y, 5-chloro-2-furoic acid, AldrichCPR, ANW-33955, CL8867, GEO-03377, MFCD00093272, NSC-35572, AKOS000122961, CS-W005615, HG-0015, MCULE-1354138883, MP-0412, RTC-030844, AJ-21768, AK-94156, AN-46628, SC-53519, AB0065473, AB1008841, DB-007011, TC-030844, 4CH-006609, FT-0080461, FT-0602744, ST24032994, Z4949, EN300-12416, 618C304, 5-Chlorofuran-2-carboxylicacid, AR-1G7726, CID234853, 66794-07-8,

Complexity	125
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	145.977g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	146.526g/mol
Monoisotopic Mass	145.977g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	UN 3261

Certificate of Analysis

Lot Number