Home Other Heterocycles 1000933-99-2
1000933-99-2,MFCD09702342
Catalog No.:AA0000TG
1000933-99-2 | Carbamic acid, N-(2-hydroxyspiro[3.3]hept-6-yl)-, 1,1-dimethylethyl ester
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100mg
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Technical Information
Catalog Number:
AA0000TG
Chemical Name:
Carbamic acid, N-(2-hydroxyspiro[3.3]hept-6-yl)-, 1,1-dimethylethyl ester
CAS Number:
1000933-99-2
Molecular Formula:
C12H21NO3
Molecular Weight:
227.3000
MDL Number:
MFCD09702342
IUPAC Name:
tert-butyl N-(2-hydroxyspiro[3.3]heptan-6-yl)carbamate
InChI:
InChI=1S/C12H21NO3/c1-11(2,3)16-10(15)13-8-4-12(5-8)6-9(14)7-12/h8-9,14H,4-7H2,1-3H3,(H,13,15)
InChI Key:
XBBQALZXPLXYDL-UHFFFAOYSA-N
SMILES:
OC1CC2(C1)CC(C2)NC(=O)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.152g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
227.304g/mol
Monoisotopic Mass:
227.152g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Synonyms
 
1000933-99-2 
2-(BOC-AMINO)-6-HYDROXYSPIRO[3.3]HEPTANE 
SCHEMBL19358642 
CTK7J8707 
DTXSID70649586 
XBBQALZXPLXYDL-UHFFFAOYSA-N 
KS-000008DS 
ANW-64585 
MFCD09702342 
ZINC12506027 
AKOS009156275 
PB34390 
tert-Butyl (6-hydroxyspiro[3.3]heptan-2-yl)carbamate 
RP07587 
AJ-62574 
AS-34918 
R244 
SC-82338 
AB0093893 
RT-017597 
ST1070404 
AM20070558 
CS-0029835 
tert-butyl N-{6-hydroxyspiro[3.3]heptan-2-yl}carbamate 
FT-0686060 
Y6758 
EN300-36307 
C-8881 
J-501677 
W-204344 
F2147-2738 
tert-butyl N-(2-hydroxyspiro[3.3]heptan-6-yl)carbamate 
(6-Hydroxy-spiro3.3hept-2-yl)-carbamic acid tert-butyl ester 
(6-Hydroxyspiro[3.3]hept-2-yl)-carbamic acid tert-butyl ester 
(6-Hydroxyspiro[3.3]hept-2-yl)carbamic acid tert-butyl ester 
1000933-99-2 2-(Boc-amino)-6-hydroxyspiro[3.3]heptane 
1000933-99-2 (6-Hydroxyspiro[3.3]hept-2-yl)carbamic acid tert-butyl ester 
Carbamic acid, N-(2-hydroxyspiro[3.3]hept-6-yl)-, 1,1-dimethylethyl ester 
C12H21NO3 
R245 
tert-butyl 6-hydroxyspiro[3.3]hept-2-ylcarbamate 
(6-Hydroxyspiro[3.3]hept-2-yl)carbamicacid tert-butyl ester 
TERT-BUTYL N-(6-HYDROXYSPIRO[3.3]HEPTAN-2-YL)CARBAMATE 
AC1Q1NBQ 
tert-butyl(6-hydroxyspiro[3.3]heptan-2-yl)carbamate 
Literature
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