AG007Q0J

118684-31-4 | tert-Butyl (3-(hydroxymethyl)phenyl)carbamate

AG007Q0J

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CAS Number	118684-31-4
Catalog Number	AG007Q0J(AGN-PC-001MD2)
Chemical Name	tert-Butyl (3-(hydroxymethyl)phenyl)carbamate
IUPAC Name	tert-butyl N-[3-(hydroxymethyl)phenyl]carbamate
InChI	InChI=1S/C12H17NO3/c1-12(2,3)16-11(15)13-10-6-4-5-9(7-10)8-14/h4-7,14H,8H2,1-3H3,(H,13,15)
InChI Key	OPMWQSDBBSURGY-UHFFFAOYSA-N
MDL Number	MFCD04974269
Molecular Formula	C12H17NO3
Molecular Weight	223.2683
SMILES	O=C(OC(C)(C)C)NC1=CC=CC(CO)=C1
Synonyms	118684-31-4, tert-Butyl (3-(hydroxymethyl)phenyl)carbamate, BOC-3-AMINOBENZYLALCOHOL, Carbamic acid, [3-(hydroxymethyl)phenyl]-, 1,1-dimethylethyl ester, tert-butyl [3-(hydroxymethyl)phenyl]carbamate, TERT-BUTYL N-[3-(HYDROXYMETHYL)PHENYL]CARBAMATE, ACMC-20mnyb, tert-butyl3-(hydroxymethyl)phenylcarbamate, 3-(Boc-amino)benzyl alcohol, SCHEMBL1858721, CTK0F9778, DTXSID50561257, OPMWQSDBBSURGY-UHFFFAOYSA-N, ZINC2541561, MFCD04974269, AKOS010227256, AK164922, 3-(tert-butoxycarbonylamino)benzyl alcohol, t-butyl-(3-(hydroxymethyl)phenyl)carbamate, tert-Butyl 3-(hydroxymethyl)phenylcarbamate, CS-0061001, ST24049498, tert-butyl[3-(hydroxymethyl)phenyl]carbamate, tert-butyl 2-(3-aminophenyl)-2-hydroxyacetate, 1-[3-[(tert-Butoxycarbonyl)amino]phenyl]methanol, (3-hydroxymethyl-phenyl)-carbamic acid tert-butyl ester, 3-(N-Boc-amino)benzyl alcohol,

Complexity	235
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.121g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	223.272g/mol
Monoisotopic Mass	223.121g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	58.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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