AG0039ZG

172348-63-9 | tert-Butyl (trans-4-hydroxymethylcyclohexylmethyl)-carbamate

AG0039ZG

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CAS Number	172348-63-9
Catalog Number	AG0039ZG(AGN-PC-0WAJR8)
Chemical Name	tert-Butyl (trans-4-hydroxymethylcyclohexylmethyl)-carbamate
IUPAC Name	tert-butyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate
InChI	InChI=1S/C13H25NO3/c1-13(2,3)17-12(16)14-8-10-4-6-11(9-15)7-5-10/h10-11,15H,4-9H2,1-3H3,(H,14,16)
InChI Key	KSXPGASLEFGROT-UHFFFAOYSA-N
MDL Number	MFCD06657666
Molecular Formula	C13H25NO3
Molecular Weight	243.3425
SMILES	O=C(OC(C)(C)C)NC[C@H]1CC[C@H](CO)CC1
Synonyms	172348-63-9, tert-Butyl (trans-4-hydroxymethylcyclohexylmethyl)carbamate, tert-Butyl (trans-4-hydroxymethylcyclohexylmethyl)-carbamate, trans-4-[(Boc-amino)methyl]cyclohexanemethanol, TRANS-4-BOC-AMINOMETHYL-1-HYDROXYMETHYL-CYCLOHEXANE, tert-Butyl ((trans-4-(hydroxymethyl)cyclohexyl)methyl)carbamate, MFCD06657666, SCHEMBL1491414, SCHEMBL3945277, SCHEMBL7816031, SCHEMBL9885059, SCHEMBL9885656, DTXSID40593365, KSXPGASLEFGROT-UHFFFAOYSA-N, KSXPGASLEFGROT-XYPYZODXSA-N, 5545AD, AR2834, ZINC35287609, ZINC100004655, ZINC146574018, RP28598, SB11030, AS-35603, CS-12643, DA-16308, SY129063, AB0073474, AX8266475, CS-0048501, MFCD06657666 (97%), K-5294, tert-butyl(trans-4-hydroxymethylcyclohexylmethyl)carbamate, tert-butyl {[4-(hydroxymethyl)cyclohexyl]methyl}carbamate, tert-butyl N-[[4-(hydroxymethyl)cyclohexyl]methyl]carbamate, trans-4-(N-tert-butoxycarbonylaminomethyl)cyclohexylmethanol, N-tert-Butoxycarbonyl-trans-4-(aminomethyl)cyclohexanemethanol, (4-Hydroxymethyl-cyclohexylmethyl)-carbamic acid tert-butyl ester, trans-4-[n-(tert-butoxycarbonyl)aminomethyl]cyclohexane-1-methanol, TERT-BUTYL ((1R,4R)-4-(HYDROXYMETHYL)CYCLOHEXYL)METHYLCARBAMATE, trans-(4-hydroxymethyl-cyclohexylmethyl)-carbamic acid tert-butyl ester, trans-(4-hydroxymethyl-cyclohexylmethyl)carbamic acid tert-butyl ester, C13H25NO3, tert-butyl (4-(hydroxymethyl)cyclohexyl)methylcarbamate, 1018674-46-8,

Complexity	240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.183g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	243.347g/mol
Monoisotopic Mass	243.183g/mol
Rotatable Bond Count	5
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
Packing Group
Precautionary statements	P264-P270-P301+P312-P330
UN Code

Certificate of Analysis

Lot Number