AG003OGG

87494-13-1 | Boc-D-Cys(Trt)-OH

AG003OGG

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CAS Number	87494-13-1
Catalog Number	AG003OGG(AGN-PC-0OL2OW)
Chemical Name	Boc-D-Cys(Trt)-OH
IUPAC Name	(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-tritylsulfanylpropanoic acid
InChI	InChI=1S/C27H29NO4S/c1-26(2,3)32-25(31)28-23(24(29)30)19-33-27(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18,23H,19H2,1-3H3,(H,28,31)(H,29,30)/t23-/m1/s1
InChI Key	JDTOWOURWBDELG-HSZRJFAPSA-N
MDL Number	MFCD00236839
Molecular Formula	C27H29NO4S
Molecular Weight	463.5885
SMILES	C(SC[C@@H](NC(=O)OC(C)(C)C)C(=O)O)(c1ccccc1)(c1ccccc1)c1ccccc1
Synonyms	boc-d-cys(trt)-oh, 87494-13-1, Boc-S-Trityl-D-Cysteine, MFCD00236839, N-alpha-t-Butyloxycarbonyl-S-trityl-D-cysteine, J-300085, Q-101675, (S)-2-((tert-Butoxycarbonyl)amino)-3-(tritylthio)propanoic acid, C27H29NO4S, AK-50196, Boc-Cys(Trt), Boc-Cys-(Trt), CTK3J7130, JDTOWOURWBDELG-HSZRJFAPSA-N, n-boc-s-trityl-d-cysteine, 98%, ACT00019, KS-00000KS5, ZINC4534296, ANW-43637, AKOS015836472, AC-6700, AM81666, CB-1665, RTR-027510, AJ-51589, BR-41445, DS-15356, AB1006956, AX8035208, TR-027510, boc-d-cys(trt)-oh boc-s-trityl-d-cysteine, FT-0686528, N-(tert-Butoxycarbonyl)-S-trityl-D-cysteine, X5764, (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-tritylsulfanylpropanoic acid, Boc-cys(trt)-OH; (S)-2-(Tertbutoxycarbonylamino)-3-(tritylthio)propanoic acid, Boc-Cys(Trt)-OH, Boc-L-cysteine(trityl), N-Boc-S-Trityl-L-cysteine, Boc-D-Cys(Trt)-OH - 1G 1g, NSC129903, ACN-033118, CID11590774, A7748, 21947-98-8, (S)-2-(Tert-butoxycarbonylamino)-3-(tritylthio)propanoic acid, Boc-S-trityl-D-cysteine; (S)-2-(Tert-butoxycarbonylamino)-3-(tritylthio)propanoic acid,

Complexity	583
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	463.182g/mol
Formal Charge	0
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	463.592g/mol
Monoisotopic Mass	463.182g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	101A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.9

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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