AG00FFZV

671802-00-9 | tert-Butyl 3-(2-Hydroxyethoxy)propanoate

AG00FFZV

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CAS Number	671802-00-9
Catalog Number	AG00FFZV(AGN-PC-005K4I)
Chemical Name	tert-Butyl 3-(2-Hydroxyethoxy)propanoate
IUPAC Name	tert-butyl 3-(2-hydroxyethoxy)propanoate
InChI	InChI=1S/C9H18O4/c1-9(2,3)13-8(11)4-6-12-7-5-10/h10H,4-7H2,1-3H3
InChI Key	ACWLDITVZGWIKA-UHFFFAOYSA-N
MDL Number	MFCD22056310
Molecular Formula	C9H18O4
Molecular Weight	190.2368
SMILES	O=C(OC(C)(C)C)CCOCCO
Synonyms	Tert-butyl 3-(2-hydroxyethoxy)propanoate, 671802-00-9, Hydroxy-PEG1-t-butyl ester, HO-PEG1-CH2CH2COOtBu, Propanoic acid, 3-(2-hydroxyethoxy)-, 1,1-dimethylethyl ester, SCHEMBL898476, ACWLDITVZGWIKA-UHFFFAOYSA-N, KM5160, MFCD22056310, ZINC79016589, AKOS027196668, AK313608, AS-18988, BP-20597, DA-41738, SC-69664, SY207220, CS-0047718, FT-0715716, MFCD22056310 (97%), 3-(2-Hydroxyethoxy)propanoic acid tert-butyl ester, Z2235810270, CID11263965,

Complexity	148
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.121g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	190.239g/mol
Monoisotopic Mass	190.121g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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