AG006M6Y

67634-00-8 | 3'-{[(2-chloroethyl)(nitroso)carbamoyl]amino}-3'-deoxythymidine

AG006M6Y

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CAS Number	67634-00-8
Catalog Number	AG006M6Y(AGN-PC-0JLFI9)
Chemical Name	3'-{[(2-chloroethyl)(nitroso)carbamoyl]amino}-3'-deoxythymidine
EC Number	266-803-5
IUPAC Name	prop-2-enyl 2-(3-methylbutoxy)acetate
InChI	InChI=1S/C10H18O3/c1-4-6-13-10(11)8-12-7-5-9(2)3/h4,9H,1,5-8H2,2-3H3
InChI Key	XCWPXUNHSPOFGV-UHFFFAOYSA-N
MDL Number	MFCD03424212
Molecular Formula	C10H18O3
Molecular Weight	186.2481
SMILES	O=C(OCCCCC)C(O)CC=C
Synonyms	Allyl (3-methylbutoxy)acetate, 67634-00-8, Glycolic acid 2-pentyloxy allyl ester, Isoamyloxyacetic acid, allyl ester, Allyl 2-(isopentyloxy)acetate, Allyl isoamyl glycolate, (3-Methylbutoxy)acetic acid, 2-propenyl ester, EINECS 266-803-5, Acetic acid, (3-methylbutoxy)-, 2-propenyl ester, Glycolic acid 2-pentyloxy allyl ester (natural), prop-2-enyl 2-(3-methylbutoxy)acetate, Acetic acid, 2-(3-methylbutoxy)-, 2-propen-1-yl ester, (3-Methylbutoxy)acetic Acid Allyl Ester, Prop-2-en-1-yl (3-methylbutoxy)acetate, W-104706, allyl(3-methylbutoxy)acetate, DSSTox_CID_5580, allyl 2-isopentyloxyacetate, AC1L30RN, DSSTox_RID_77839, DSSTox_GSID_25580, Allyl (isopentyloxy)acetate #, SCHEMBL273059, AC1Q60F0, CHEMBL1581032, DTXSID9025580, allyl (3-methyl butoxy) acetate, CTK9A0073, XCWPXUNHSPOFGV-UHFFFAOYSA-N, ZINC2573510, Tox21_200351, MFCD03424212, AKOS015901765, LS-1572, NCGC00091840-01, NCGC00091840-02, NCGC00257905-01, AJ-42149, AN-38301, CAS-67634-00-8, 3-Methylbutoxy-acetic acid, 2-propenyl ester, 634A008, PROP-2-EN-1-YL 2-(3-METHYLBUTOXY)ACETATE, I14-14694, allyl amyl glycolate, amyl allyl glycolate, allyl (3 - methylbutoxy)acetate, C10H18O3, AR-1H6805, CID106729, C10-H18-O3, A3185, 68310-08-7,

Complexity	152
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.126g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	186.251g/mol
Monoisotopic Mass	186.126g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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