Cas no 112275-50-0 (Tert-butyl 1,4-diazepane-1-carboxylate)

Tert-butyl 1,4-diazepane-1-carboxylate structure
112275-50-0 structure
Product Name:Tert-butyl 1,4-diazepane-1-carboxylate
CAS No:112275-50-0
MF:C10H20N2O2
MW:200.278002738953
MDL:MFCD00276987
CID:62919
PubChem ID:24873442
Update Time:2025-04-18

Tert-butyl 1,4-diazepane-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl 1,4-diazepane-1-carboxylate
    • 1-(tert-Butoxycarbonyl)homopiperazine~tert-Butyl hexahydro-1,4-diazepine-1-carboxylate
    • 1-Boc-hexahydro-1,4-diazepine
    • 1-(TERT-BUTOXYCARBONYL)HOMOPIPERAZINE
    • 1-Boc-homopiperazine
    • tert-Butyl homopiperazine-1-carboxylate
    • HPBOC
    • BOC-HOPAZ
    • BOC-HOPIZ
    • Boc-HomoPiz
    • Boc-HoPaz*HCl
    • Boc-HoPiz, liq.
    • BUTTPARK 27\08-71
    • BOC-HOMOPIPERAZINE
    • 1-BOC-1,4-DIAZEPANE
    • [1,4]diazepane-1-carboxylic acid tert-butyl ester
    • n-boc-homopiperazine
    • N-(tert-Butoxycarbonyl)homopiperazine
    • tert-butyl 1-homopiperazinecarboxylate
    • tert-butyl 1,4-diazaperhydroepinecarboxylate
    • n-boc homopiperazine
    • 1-BOC-homopiperizine
    • PubChem13492
    • 1-N-Boc-Homopi
    • 4-Boc-1,4-diazepane
    • BOC
    • FT-0652082
    • 1-(t-B utyloxycarbonyl)- 1,4-diazepane
    • N-tert-butyloxycarbonyl-homopiperazine
    • homopiperazine-carboxylic acid tert-butyl ester
    • Q-102280
    • BCP22542
    • B6228
    • 1-tert-butoxycarbonylhomopiperazine
    • VU0494717-1
    • 1-(t-butoxycarbonyl)homopiperazine
    • tert-butyl 1-homopiperazine-carboxylate
    • WDPWEXWMQDRXAL-UHFFFAOYSA-N
    • 1-(tert-butoxycarbonyl)-hexahydro-1H-1,4-diazepine
    • 1-(tert-butyloxycarbonyl)homopiperazine
    • FT-0607415
    • 1-tert-butoxycarbonyl-2,3,5,6-tetrahydro-7h-1,4-diazepine
    • tert-butyl1,4-diazepane-1-carboxylate
    • AKOS005171648
    • [1,4] Diazepane-1-carboxylic acid tert butyl ester
    • t-butyl 1,4-diazepane-1-carboxylate
    • 1-Boc-[1,4]diazepane
    • 1-tert-butoxycarbonyl-homopiperazine
    • 1,4-Diazepane, N1-BOC protected
    • 112275-50-0
    • MFCD00276987
    • tert-butylhomopiperazine-1-carboxylate
    • AM20080075
    • DTXSID30373214
    • 1,4-Diazepane-1-carboxylic acid tert-butyl ester
    • tert-butyl-1-homopiperazinecarboxylate
    • N-(t-Butyloxycarbonyl)-homopiperazine hydrochloride
    • 1-(t-Butyloxycarbonyl)-1,4-diazepane
    • 1-tert.-butyloxycarbonyl-[1,4]diazepan
    • 1-homopiperazine carboxylic acid tert-butyl ester
    • F2145-0196
    • tert-butoxycarbonyl homopiperazine
    • SY004264
    • 1-t-butoxycarbonylhomopiperazine
    • CS-D0683
    • tert-butyl 1,4-diazepan-1-carboxylate
    • 1,1-dimethylethyl 1,4-diazepane-1-carboxylate
    • tert-butyl-1-homopiperazine carboxylate
    • 1-(t-Butyloxycarbonyl)- 1 4-diazepane
    • homo-piperazine-1-carboxylic acid tert-butyl ester
    • C10H20N2O2
    • TERT-BUTYL 1,4-DIAZOCANE-1-CARBOXYLATE
    • t-Butyloxycarbonyl-1,4-diazepane
    • tert-butyl 1-homopiperazine carboxylate
    • t-butyl 1-homopiperazine carboxylate
    • HY-40181
    • EN300-50972
    • 1-Boc-hexahydro-1,4-diazepine, 98%
    • PS-3588
    • tert-butyl hexahydro-1H-1,4-diazepine-1-carboxylate
    • 1,1-dimethylethyl hexahydro-1H-1,4-diazepine-1-carboxylate
    • SCHEMBL40106
    • AC-2384
    • HEXAHYDRO-1H-1,4-DIAZEPINE-1-CARBOXYLIC ACID, 1,1-DIMETHYLETHYL ESTER
    • 1-Boc-[1,4]diazapane
    • AB05896
    • STK504198
    • ALBB-006930
    • DB-031846
    • Tert-butyl 1,4-diazepane-1-carboxylate
    • MDL： MFCD00276987
    • Inchi： 1S/C10H20N2O2/c1-10(2,3)14-9(13)12-7-4-5-11-6-8-12/h11H,4-8H2,1-3H3
    • InChI Key： WDPWEXWMQDRXAL-UHFFFAOYSA-N
    • SMILES： O(C(N1CCNCCC1)=O)C(C)(C)C
    • BRN： 7581789

Computed Properties

  • Exact Mass: 200.15200
  • Monoisotopic Mass: 200.152
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 199
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 41.6
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 0.8

Experimental Properties

  • Color/Form: Light yellow or colorless liquid
  • Density: 1.016?g/mL?at 20?°C(lit.)
  • Melting Point: No data available
  • Boiling Point: 95-110?°C/0.5?mmHg(lit.)
  • Flash Point: Degrees Fahrenheit:230°F
    Degrees Celsius:110°C
  • Refractive Index: n20/D 1.471(lit.)
  • Water Partition Coefficient: Not miscible or difficult to mix in water.
  • PSA: 41.57000
  • LogP: 1.48350
  • Sensitiveness: Air Sensitive
  • Solubility: Insoluble in water

Tert-butyl 1,4-diazepane-1-carboxylate Security Information

  • Symbol: GHS07
  • Signal Word：Warning
  • Hazard Statement： H315,H319,H335
  • Warning Statement： P261,P305+P351+P338
  • Hazardous Material transportation number：NONH for all modes of transport
  • WGK Germany：3
  • Hazard Category Code： 36/37/38
  • Safety Instruction： S26-S36
  • FLUKA BRAND F CODES：10-34
  • Hazardous Material Identification： Xi
  • Safety Term：S26;S36
  • HazardClass：8
  • Storage Condition：Keep in dark place,Inert atmosphere,2-8°C
  • Risk Phrases：R36/37/38

Tert-butyl 1,4-diazepane-1-carboxylate Customs Data

  • HS CODE：2933990090
  • Customs Data：

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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