AG003ETI

62563-07-9 | 2-(3-Bromopropyl)-1,3-dioxolane

AG003ETI

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CAS Number	62563-07-9
Catalog Number	AG003ETI(AGN-PC-0JQDG1)
Chemical Name	2-(3-Bromopropyl)-1,3-dioxolane
IUPAC Name	2-(3-bromopropyl)-1,3-dioxolane
InChI	InChI=1S/C6H11BrO2/c7-3-1-2-6-8-4-5-9-6/h6H,1-5H2
InChI Key	IQIXIJRPYSOGPY-UHFFFAOYSA-N
MDL Number	MFCD09868694
Molecular Formula	C6H11BrO2
Molecular Weight	195.0543
NSC Number	617308
SMILES	BrCCCC1OCCO1
Synonyms	2-(3-bromopropyl)-1,3-dioxolane, 62563-07-9, 1,3-Dioxolane, 2-(3-bromopropyl)-, IQIXIJRPYSOGPY-UHFFFAOYSA-N, 2-(3-Bromopropyl)-[1,3]dioxolane, NSC617308, AC1L7B7N, AC1Q27UA, SCHEMBL889477, ACMC-209n58, CTK2B7280, DTXSID20326815, 4-bromobutyraldehyde ethylene ketal, ZINC1613259, 4-Bromobutylaldehyde Ethylene Acetal, 4-Bromobutyraldehyde Ethylene Acetal, ANW-34266, MFCD09868694, AKOS015836139, NSC-617308, AS-40736, BC005094, TR-037325, B3463, I14-107896, CID357783,

Complexity	71.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.994g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	195.056g/mol
Monoisotopic Mass	193.994g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H227
Packing Group	Ⅲ
Precautionary statements	P210-P280-P403+P235-P501
UN Code	UN 1993

Certificate of Analysis

Lot Number