AG00334R

33170-72-8 | 2-Bromo-1,1-dimethoxypropane

AG00334R

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CAS Number	33170-72-8
Catalog Number	AG00334R(AGN-PC-05SPOO)
Chemical Name	2-Bromo-1,1-dimethoxypropane
IUPAC Name	2-bromo-1,1-dimethoxypropane
InChI	InChI=1S/C5H11BrO2/c1-4(6)5(7-2)8-3/h4-5H,1-3H3
InChI Key	HFTQXLCZRCQAAX-UHFFFAOYSA-N
MDL Number	MFCD11505877
Molecular Formula	C5H11BrO2
Molecular Weight	183.0436
SMILES	BrC(C(OC)OC)C
Synonyms	2-Bromo-1,1-dimethoxypropane, 33170-72-8, 2-Bromo-1,1-dimethoxy-propane, Propane, 2-bromo-1,1-dimethoxy-, ACMC-209hyu, 2-bromopropanal dimethyl acetal, SCHEMBL1674231, CTK6J3082, DTXSID50485181, HFTQXLCZRCQAAX-UHFFFAOYSA-N, bromopropionaldehyde dimethyl acetal, ANW-27556, MFCD11505877, 2-bromopropionaldehyde dimethyl acetal, AKOS006324819, AB64104, RP08315, TRA-0191498, AK-40506, AS-17971, SY025539, TC-068196, FT-0685624, V5228, MFCD11505877 (95%), K-7642, M111100, J-508167, C5H11BrO2,

Complexity	54.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.994g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	183.045g/mol
Monoisotopic Mass	181.994g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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