AG00IB5R

63164-16-9 | Butanoic acid, 2,4-dibromo-

AG00IB5R

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CAS Number	63164-16-9
Catalog Number	AG00IB5R(AGN-PC-00K69A)
Chemical Name	Butanoic acid, 2,4-dibromo-
IUPAC Name	2,4-dibromobutanoic acid
InChI	InChI=1S/C4H6Br2O2/c5-2-1-3(6)4(7)8/h3H,1-2H2,(H,7,8)
InChI Key	OFBPRWUYMOUQML-UHFFFAOYSA-N
MDL Number	MFCD01632493
Molecular Formula	C4H6Br2O2
Molecular Weight	245.8972
SMILES	O=C(O)C(Br)CCBr
Synonyms	2,4-Dibromobutanoic acid, 2,4-Dibromobutyric acid, 63164-16-9, 2,4-Dibromo-butyric acid, Butanoic acid, 2,4-dibromo-, 2,4-Dibromo-butyricacid, Butanoicacid, 2,4-dibromo-, SCHEMBL197999, alpha,gamma-dibromobutyric acid, CTK2F2699, DTXSID80513522, OFBPRWUYMOUQML-UHFFFAOYSA-N, ACT09951, BCP25367, MFCD01632493, AKOS022172430, FCH1318947, AN-38999, AX8066595, FT-0609987, Z-4976, 164D169,

Complexity	84.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	245.871g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	245.898g/mol
Monoisotopic Mass	243.873g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H319
Precuationary statements	P305+P351+P338
Siginal words

Certificate of Analysis

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