AG003PTS

615-83-8 | DL-Ethyl 2-Bromovalerate

AG003PTS

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CAS Number	615-83-8
Catalog Number	AG003PTS(AGN-PC-0WACXK)
Chemical Name	DL-Ethyl 2-Bromovalerate
EC Number	210-450-1
IUPAC Name	ethyl 2-bromopentanoate
InChI	InChI=1S/C7H13BrO2/c1-3-5-6(8)7(9)10-4-2/h6H,3-5H2,1-2H3
InChI Key	ORSIRXYHFPHWTN-UHFFFAOYSA-N
MDL Number	MFCD00000159
Molecular Formula	C7H13BrO2
Molecular Weight	209.0809
NSC Number	8865
SMILES	CCCC(Br)C(OCC)=O
Synonyms	Ethyl 2-bromovalerate, 615-83-8, Ethyl 2-bromopentanoate, ethyl2-bromovalerate, 2-Bromovaleric Acid Ethyl Ester, 2-Bromopentanoic acid ethyl ester, MFCD00000159, Ethyl .alpha.-bromovalerate, Pentanoic acid, 2-bromo-, ethyl ester, ORSIRXYHFPHWTN-UHFFFAOYSA-N, 2-bromo-pentanoic acid ethyl ester, Pentanoic acid, bromo-, ethyl ester, 112889-44-8, DL-Ethyl 2-bromovalerate, 99%, ethyl bromovalerate, EINECS 210-450-1, ethyl-2bromovalerate, ethyl-2-bromopentanoate, Ethyl alpha-bromovalerate, ethyl-(2-bromovalerate), AC1L2WLD, AC1Q2UIA, rac-ethyl 2-bromovalerate, ACMC-1BB9T, Ethanol, 2-bromopentanoate, Ethyl 2-bromopentanoate #, Ethyl 2-bromovalerate, 99%, SCHEMBL304907, AC1Q245J, CTK0D0849, DTXSID40275770, NSC8865, NSC-8865, ANW-33874, AKOS016008686, RL04326, TRA0161195, KS-00000X61, AS-17274, SC-22687, U174, DB-053937, RT-004167, E0970, FT-0625458, ST24033179, M-2115, J-802202, W-105126, I14-92227, Ethyl acetonoxalate, DL-Ethyl 2-Bromovalerate, C7H13BrO2, Pentanoic acid, ethyl ester, ETHYL-2-BROMOVALERATE, METHYLMAGNESIUM CHLORIDE, (+/-)-Ethyl-2-bromovalerate, C7-H13-Br-O2, CID79071, AR-1I8337, Ethyl 2-bromovalerate, 98% - 100G 100g, 6282-97-9,

Complexity	104
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.01g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	209.083g/mol
Monoisotopic Mass	208.01g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314-H335
Packing Group	Ⅱ
Precautionary statements	P261-P280-P305+P351+P338-P310
UN Code	UN 3265

Certificate of Analysis

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