AG002N96

234443-21-1 | 1-Butanol, 4-bromo-3,3,4,4-tetrafluoro-

AG002N96

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CAS Number	234443-21-1
Catalog Number	AG002N96(AGN-PC-0QZP86)
Chemical Name	1-Butanol, 4-bromo-3,3,4,4-tetrafluoro-
IUPAC Name	4-bromo-3,3,4,4-tetrafluorobutan-1-ol
InChI	InChI=1S/C4H5BrF4O/c5-4(8,9)3(6,7)1-2-10/h10H,1-2H2
InChI Key	RTTCOQHNKANLOS-UHFFFAOYSA-N
MDL Number	MFCD00077467
Molecular Formula	C4H5BrF4O
Molecular Weight	224.9795
SMILES	OCCC(F)(F)C(F)(Br)F
Synonyms	4-bromo-3,3,4,4-tetrafluorobutan-1-ol, 234443-21-1, 4-Bromo-3,3,4,4-tetrafluoro-1-butanol, zlchem 1314, AC1MC5FO, C4H5BrF4O, SCHEMBL246920, CTK4F1481, DTXSID90371312, PC1561F, ZLE0090, RTTCOQHNKANLOS-UHFFFAOYSA-N, ZINC2555160, ZX-AP004507, 7934AD, FD2046, MFCD00077467, SBB096749, 4-bromo-3,3,4,4-tetrafluorobutanol, AKOS007929963, FCH1321071, RP27543, RTR-010892, AJ-39711, AK139971, AN-29440, AS-48921, 1-Butanol,4-bromo-3,3,4,4-tetrafluoro-, 4-bromo-3,3,4,4-tetrafluoro-butan-1-ol, AX8094965, TR-010892, 1-Butanol, 4-bromo-3,3,4,4-tetrafluoro-, 4-Bromo-1H,1H,2H,2H-perfluorobutan-1-ol, FT-0676101, ST24043410, C-5617, 443B211, A816718, C-53532, 3S102425, 4-bromanyl-3,3,4,4-tetrakis(fluoranyl)butan-1-ol, J-514702, I14-25882, ZINC02555160, CID2736369,

Complexity	116
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.946g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	224.981g/mol
Monoisotopic Mass	223.946g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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