AG0032FR

60456-22-6 | (S)-(-)-3-Chloro-1,2-propanediol acetonide

AG0032FR

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CAS Number	60456-22-6
Catalog Number	AG0032FR(AGN-PC-0OD3X1)
Chemical Name	(S)-(-)-3-Chloro-1,2-propanediol acetonide
IUPAC Name	(4S)-4-(chloromethyl)-2,2-dimethyl-1,3-dioxolane
InChI	InChI=1S/C6H11ClO2/c1-6(2)8-4-5(3-7)9-6/h5H,3-4H2,1-2H3/t5-/m1/s1
InChI Key	BNPOTXLWPZOESZ-RXMQYKEDSA-N
MDL Number	MFCD00273365
Molecular Formula	C6H11ClO2
Molecular Weight	150.6033
SMILES	CC1(C)OC[C@@H](CCl)O1
Synonyms	60456-22-6, (S)-4-(chloromethyl)-2,2-dimethyl-1,3-dioxolane, (S)-4-Chloromethyl-2,2-dimethyl-1,3-dioxolane, (4S)-4-(chloromethyl)-2,2-dimethyl-1,3-dioxolane, (S)-(-)-4-(Chloromethyl)-2,2-dimethyl-1,3-dioxolane, (S)-(-)-4-chloromethyl-2,2-dimethyl-1,3-dioxolane, (S)-(+)-4-Chloromethyl-2,2-dimethyl--1,3-dioxolane, 1,3-Dioxolane, 4-(chloromethyl)-2,2-dimethyl-, (S)-, (S)-(-)-4-(Chloromethyl)-2,2-dimethyl-1,3-dioxolane, 98%, AK-35811, PubChem14076, AC1OC0TA, SCHEMBL1077396, BNPOTXLWPZOESZ-RXMQYKEDSA-, BNPOTXLWPZOESZ-RXMQYKEDSA-N, ZINC152341, KS-000000KX, ANW-33501, DT1847, FCH964014, MFCD00273365, AKOS015848755, AC-6920, HCH0014709, LS30255, AJ-12730, BP-21447, CS-11303, OR323249, U392, ZB005167, AX8021719, TC-122246, C1796, FT-0605262, ST24036173, (S)-4-Chloromethyl-2,2-dimethyl-[1,3]dioxolane, 456C226, (S)-(+)-4-Chloromethyl-2,2-dimethyl-­1,3-dioxolane, UNII-0366925SM9 component BNPOTXLWPZOESZ-RXMQYKEDSA-N, InChI=1/C6H11ClO2/c1-6(2)8-4-5(3-7)9-6/h5H,3-4H2,1-2H3/t5-/m1/s1, C6H11ClO2, (S)-(-)-3-Chloro-1,2-propanediol acetonide, CB11707, CID6930483, BRN 0104463, (S)-(+)-4-(Chloromethyl)-2,2-dimethyl-1,3-dioxolane, 1,3-Dioxolane, 4-(chloromethyl)-2,2-dimethyl-, (4S)- (9CI),

Complexity	103
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	150.045g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	150.602g/mol
Monoisotopic Mass	150.045g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3(6.1)
Hazard statements	H226-H301-H318
Packing Group	Ⅲ
Precautionary statements	P280-P301+P310-P305+P351+P338
UN Code	UN 1992

Certificate of Analysis

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